PUBLICACIÓN

Norcaradiene-Cycloheptatriene Equilibrium: A Heavy-Atom Quantum Tunneling Case

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ACCEDER A LA PUBLICACIÓN: Scopus Orcid

Juan García de la Concepción, José C. Corchado, Pedro Cintas, Reyes Babiano

2024 JOURNAL OF ORGANIC CHEMISTRY

Organic Chemistry (Q2)

JCR: 3.6

SJR: 0.737

CITAS

1

DOI

10.1021/acs.joc.4c00464

EID

2-s2.0-85196638750

ISSN

0022-3263

EISSN

1520-6904

AUTORES DE LA UEX

Pedro Cintas Moreno
Juan García De La Concepción
José Carlos Corchado Martín-Romo

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Electronic Effects In Tautomeric Equilibria: The Case Of Chiral Imines From D-Glucamine And 2-Hydroxyacetophenones
Interactions Of Amino Acids And Aminoxazole Derivatives: Cocrystal Formation And Prebiotic Implications Enabled By Computational Analysis
Electronic Effects In Tautomeric Equilibria: The Case Of Chiral Imines From D-Glucamine And 2-Hydroxyacetophenones
Formation Of: S -Alkyl Thiophenium Ionic Liquids: Mechanistic Rationale And Structural Relationships
Electronic Effects In Tautomeric Equilibria: The Case Of Chiral Imines From D-Glucamine And 2-Hydroxyacetophenones
Formation Of: S -Alkyl Thiophenium Ionic Liquids: Mechanistic Rationale And Structural Relationships
Tautomerism And Stereodynamics In Schiff Bases From Gossypol And Hemigossypol With: N-Aminoheterocycles
Formation Of: S -Alkyl Thiophenium Ionic Liquids: Mechanistic Rationale And Structural Relationships
Tautomerism And Stereodynamics In Schiff Bases From Gossypol And Hemigossypol With: N-Aminoheterocycles
From Prebiotic Chemistry To Supramolecular Oligomers: Urea-Glyoxal Reactions
Tautomerism And Stereodynamics In Schiff Bases From Gossypol And Hemigossypol With: N-Aminoheterocycles
From Prebiotic Chemistry To Supramolecular Oligomers: Urea-Glyoxal Reactions
Cork Wastewater Purification In A Cooperative Flocculation/adsorption Process With Microwave-Regenerated Activated Carbon
From Prebiotic Chemistry To Supramolecular Oligomers: Urea-Glyoxal Reactions
Cork Wastewater Purification In A Cooperative Flocculation/adsorption Process With Microwave-Regenerated Activated Carbon
Computational Screening Of New Orthogonal Metal-Free Dipolar Cycloadditions Of Mesomeric Betaines
Cork Wastewater Purification In A Cooperative Flocculation/adsorption Process With Microwave-Regenerated Activated Carbon
Computational Screening Of New Orthogonal Metal-Free Dipolar Cycloadditions Of Mesomeric Betaines
On The Asymmetric Autocatalysis Of Aldol Reactions: The Case Of 4-Nitrobenzaldehyde And Acetone. A Critical Appraisal With A Focus On Theory
Computational Screening Of New Orthogonal Metal-Free Dipolar Cycloadditions Of Mesomeric Betaines
On The Asymmetric Autocatalysis Of Aldol Reactions: The Case Of 4-Nitrobenzaldehyde And Acetone. A Critical Appraisal With A Focus On Theory
Formation Of Cyanamide–glyoxal Oligomers In Aqueous Environments Relevant To Primeval And Astrochemical Scenarios: A Spectroscopic And Theoretical Study
On The Asymmetric Autocatalysis Of Aldol Reactions: The Case Of 4-Nitrobenzaldehyde And Acetone. A Critical Appraisal With A Focus On Theory
Formation Of Cyanamide–glyoxal Oligomers In Aqueous Environments Relevant To Primeval And Astrochemical Scenarios: A Spectroscopic And Theoretical Study
Highly Efficient Nitrobenzene And Alkyl/aryl Azide Reduction In Stainless Steel Jars Without Catalyst Addition
Formation Of Cyanamide–glyoxal Oligomers In Aqueous Environments Relevant To Primeval And Astrochemical Scenarios: A Spectroscopic And Theoretical Study
Highly Efficient Nitrobenzene And Alkyl/aryl Azide Reduction In Stainless Steel Jars Without Catalyst Addition
On The Dual Reactivity Of A Janus-Type Mesoionic Dipole: Experiments And Theoretical Validation
Highly Efficient Nitrobenzene And Alkyl/aryl Azide Reduction In Stainless Steel Jars Without Catalyst Addition
On The Dual Reactivity Of A Janus-Type Mesoionic Dipole: Experiments And Theoretical Validation
Mechanistic Studies Of 1,3-Dipolar Cycloadditions Of Bicyclic Thioisomünchnones With Alkenes. A Computational Rationale Focused On Donor-Acceptor Interactions
On The Dual Reactivity Of A Janus-Type Mesoionic Dipole: Experiments And Theoretical Validation
Mechanistic Studies Of 1,3-Dipolar Cycloadditions Of Bicyclic Thioisomünchnones With Alkenes. A Computational Rationale Focused On Donor-Acceptor Interactions
Effects Of Ultrasonic And Hydrodynamic Cavitation On The Treatment Of Cork Wastewater By Flocculation And Fenton Processes
Mechanistic Studies Of 1,3-Dipolar Cycloadditions Of Bicyclic Thioisomünchnones With Alkenes. A Computational Rationale Focused On Donor-Acceptor Interactions
Effects Of Ultrasonic And Hydrodynamic Cavitation On The Treatment Of Cork Wastewater By Flocculation And Fenton Processes
F(2p) + C2h6 → Hf + C2h5 Kinetics Study Based On A New Analytical Potential Energy Surface
Effects Of Ultrasonic And Hydrodynamic Cavitation On The Treatment Of Cork Wastewater By Flocculation And Fenton Processes
F(2p) + C2h6 → Hf + C2h5 Kinetics Study Based On A New Analytical Potential Energy Surface
Assessing Stereoelectronic Effects In Dipolar Cycloadditions Yielding Fused Thiazolopyridone Rings
F(2p) + C2h6 → Hf + C2h5 Kinetics Study Based On A New Analytical Potential Energy Surface
Assessing Stereoelectronic Effects In Dipolar Cycloadditions Yielding Fused Thiazolopyridone Rings
Microwave Chemistry: History, Development And Legacy
Assessing Stereoelectronic Effects In Dipolar Cycloadditions Yielding Fused Thiazolopyridone Rings
Microwave Chemistry: History, Development And Legacy
Merging Metallic Catalysts And Sonication: A Periodic Table Overview
Microwave Chemistry: History, Development And Legacy
Merging Metallic Catalysts And Sonication: A Periodic Table Overview
Cycloadditions With Mesoionic Dipoles: Strategy And Control
Merging Metallic Catalysts And Sonication: A Periodic Table Overview
Cycloadditions With Mesoionic Dipoles: Strategy And Control
Assessing Stereoelectronic Effects In Dipolar Cycloadditions Yielding Fused Thiazolopyridone Rings
Cycloadditions With Mesoionic Dipoles: Strategy And Control
Assessing Stereoelectronic Effects In Dipolar Cycloadditions Yielding Fused Thiazolopyridone Rings
Theoretical Study Of The Pair-Correlated F + Chd3(V = 0,ν1 = 1) Reaction: Effect Of Ch Stretching Vibrational Excitation
Assessing Stereoelectronic Effects In Dipolar Cycloadditions Yielding Fused Thiazolopyridone Rings
Theoretical Study Of The Pair-Correlated F + Chd3(V = 0,ν1 = 1) Reaction: Effect Of Ch Stretching Vibrational Excitation
Qct Dynamics Study Of Oh/od + Geh4 Reactions. The Problem Of Water Bending Excitation
Theoretical Study Of The Pair-Correlated F + Chd3(V = 0,ν1 = 1) Reaction: Effect Of Ch Stretching Vibrational Excitation
Qct Dynamics Study Of Oh/od + Geh4 Reactions. The Problem Of Water Bending Excitation
¿qué Sabemos De La Talidomida?
Qct Dynamics Study Of Oh/od + Geh4 Reactions. The Problem Of Water Bending Excitation
¿qué Sabemos De La Talidomida?
Homochirogenesis And The Emergence Of Lifelike Structures
¿qué Sabemos De La Talidomida?
Homochirogenesis And The Emergence Of Lifelike Structures
Prebiotic-Like Condensations Of Cyanamide And Glyoxal: Revisiting Intractable Biotars
Homochirogenesis And The Emergence Of Lifelike Structures
Prebiotic-Like Condensations Of Cyanamide And Glyoxal: Revisiting Intractable Biotars
Ultrasound And Green Chemistry - Further Comments
Prebiotic-Like Condensations Of Cyanamide And Glyoxal: Revisiting Intractable Biotars
Ultrasound And Green Chemistry - Further Comments
Enantiomer-Specific Oriented Attachment Of Guanidine Carbonate Crystals
Ultrasound And Green Chemistry - Further Comments
Enantiomer-Specific Oriented Attachment Of Guanidine Carbonate Crystals
Peer Review: From Recognition To Improved Practices
Enantiomer-Specific Oriented Attachment Of Guanidine Carbonate Crystals
Peer Review: From Recognition To Improved Practices
On The Plausibility Of Pseudosugar Formation In Cometary Ices And Oxygen-Rich Tholins
Peer Review: From Recognition To Improved Practices
On The Plausibility Of Pseudosugar Formation In Cometary Ices And Oxygen-Rich Tholins
A Further Look At Π-Delocalization And Hydrogen Bonding In 2-Arylmalondialdehydes
On The Plausibility Of Pseudosugar Formation In Cometary Ices And Oxygen-Rich Tholins
A Further Look At Π-Delocalization And Hydrogen Bonding In 2-Arylmalondialdehydes
Oriented Attachment By Enantioselective Facet Recognition In Millimeter-Sized Gypsum Crystals
A Further Look At Π-Delocalization And Hydrogen Bonding In 2-Arylmalondialdehydes
Oriented Attachment By Enantioselective Facet Recognition In Millimeter-Sized Gypsum Crystals
Computational Insights Into Cycloadditions Of Thioisomünchnones With Acetylenes: How Does Sulfur Escape From Cycloadducts?
Oriented Attachment By Enantioselective Facet Recognition In Millimeter-Sized Gypsum Crystals
Computational Insights Into Cycloadditions Of Thioisomünchnones With Acetylenes: How Does Sulfur Escape From Cycloadducts?
Rate Constant Calculations Of The Geh4 + Oh/od → Geh3 + H2o/hod Reactions Using An: Ab Initio Based Full-Dimensional Potential Energy Surface
Computational Insights Into Cycloadditions Of Thioisomünchnones With Acetylenes: How Does Sulfur Escape From Cycloadducts?
Rate Constant Calculations Of The Geh4 + Oh/od → Geh3 + H2o/hod Reactions Using An: Ab Initio Based Full-Dimensional Potential Energy Surface
Vibrational, Rotational And Translational Effects On The Oh(V, J) + Ch4(V 1, V 2, V 3, V 4) Dynamics Reaction: A Quasi-Classical Trajectory Study
Rate Constant Calculations Of The Geh4 + Oh/od → Geh3 + H2o/hod Reactions Using An: Ab Initio Based Full-Dimensional Potential Energy Surface
Vibrational, Rotational And Translational Effects On The Oh(V, J) + Ch4(V 1, V 2, V 3, V 4) Dynamics Reaction: A Quasi-Classical Trajectory Study
Pair-Correlated Speed Distributions For The Oh+ch4/cd4 Reactions: Further Remarks On Their Classical Trajectory Calculations In A Quantum Spirit
Vibrational, Rotational And Translational Effects On The Oh(V, J) + Ch4(V 1, V 2, V 3, V 4) Dynamics Reaction: A Quasi-Classical Trajectory Study
Pair-Correlated Speed Distributions For The Oh+ch4/cd4 Reactions: Further Remarks On Their Classical Trajectory Calculations In A Quantum Spirit
Product Translational And Vibrational Distributions For The Oh/od + Ch4/cd4 Reactions From Quasiclassical Trajectory Calculations. Comparison With Experiment
Pair-Correlated Speed Distributions For The Oh+ch4/cd4 Reactions: Further Remarks On Their Classical Trajectory Calculations In A Quantum Spirit
Product Translational And Vibrational Distributions For The Oh/od + Ch4/cd4 Reactions From Quasiclassical Trajectory Calculations. Comparison With Experiment
A New Qm/mm Method Oriented To The Study Of Ionic Liquids
Product Translational And Vibrational Distributions For The Oh/od + Ch4/cd4 Reactions From Quasiclassical Trajectory Calculations. Comparison With Experiment
A New Qm/mm Method Oriented To The Study Of Ionic Liquids
Jjl: More Than An Educator
A New Qm/mm Method Oriented To The Study Of Ionic Liquids
Jjl: More Than An Educator
Interplay Between Mechanochemistry And Sonochemistry
Jjl: More Than An Educator
Interplay Between Mechanochemistry And Sonochemistry
Crystallization Of Chiral Molecules
Interplay Between Mechanochemistry And Sonochemistry
Crystallization Of Chiral Molecules
Enabling Technologies Built On A Sonochemical Platform: Challenges And Opportunities
Crystallization Of Chiral Molecules
Enabling Technologies Built On A Sonochemical Platform: Challenges And Opportunities
Complexes Of Peracetylated Cyclodextrin In A Non-Aqueous Aprotic Medium: The Role Of Residual Water
Enabling Technologies Built On A Sonochemical Platform: Challenges And Opportunities
Complexes Of Peracetylated Cyclodextrin In A Non-Aqueous Aprotic Medium: The Role Of Residual Water
Erratum: Reconfiguration Of Stereoisomers Under Sonomechanical Activation (Angewandte Chemie - International Edition (2010) (49) Doi: 10.1002/anie.201001360)
Complexes Of Peracetylated Cyclodextrin In A Non-Aqueous Aprotic Medium: The Role Of Residual Water
Erratum: Reconfiguration Of Stereoisomers Under Sonomechanical Activation (Angewandte Chemie - International Edition (2010) (49) Doi: 10.1002/anie.201001360)
Adding Only One Priority Rule Allows Extending Cip Rules To Supramolecular Systems
Erratum: Reconfiguration Of Stereoisomers Under Sonomechanical Activation (Angewandte Chemie - International Edition (2010) (49) Doi: 10.1002/anie.201001360)
Adding Only One Priority Rule Allows Extending Cip Rules To Supramolecular Systems
Rethinking Aromaticity In H-Bonded Systems. Caveats For Transition Structures Involving Hydrogen Transfer And Π-Delocalization
Adding Only One Priority Rule Allows Extending Cip Rules To Supramolecular Systems
Rethinking Aromaticity In H-Bonded Systems. Caveats For Transition Structures Involving Hydrogen Transfer And Π-Delocalization
On The Energy-Dependence Of The Excitation Functions Of The H+ch4 And H+cd4 Reactions
Rethinking Aromaticity In H-Bonded Systems. Caveats For Transition Structures Involving Hydrogen Transfer And Π-Delocalization
On The Energy-Dependence Of The Excitation Functions Of The H+ch4 And H+cd4 Reactions
Final State-Resolved Mode Specificity In Hx + Oh → X + H2o (X = F And Cl) Reactions: A Quasi-Classical Trajectory Study
On The Energy-Dependence Of The Excitation Functions Of The H+ch4 And H+cd4 Reactions
Final State-Resolved Mode Specificity In Hx + Oh → X + H2o (X = F And Cl) Reactions: A Quasi-Classical Trajectory Study
Qct Dynamics Study Of The Reaction Of Hydroxyl Radical And Methane Using A New Ab Initio Fitted Full-Dimensional Analytical Potential Energy Surface
Final State-Resolved Mode Specificity In Hx + Oh → X + H2o (X = F And Cl) Reactions: A Quasi-Classical Trajectory Study
Qct Dynamics Study Of The Reaction Of Hydroxyl Radical And Methane Using A New Ab Initio Fitted Full-Dimensional Analytical Potential Energy Surface
Quasi-Classical Trajectory Study Of The Water Vibrational Distribution For The Polyatomic Oh/od + Nh3 Reactions: Comparison With Experiment
Qct Dynamics Study Of The Reaction Of Hydroxyl Radical And Methane Using A New Ab Initio Fitted Full-Dimensional Analytical Potential Energy Surface
Quasi-Classical Trajectory Study Of The Water Vibrational Distribution For The Polyatomic Oh/od + Nh3 Reactions: Comparison With Experiment
Theoretical Study Of Solvent Effects On The Ground And Low-Lying Excited Free Energy Surfaces Of A Push-Pull Substituted Azobenzene
Quasi-Classical Trajectory Study Of The Water Vibrational Distribution For The Polyatomic Oh/od + Nh3 Reactions: Comparison With Experiment
Theoretical Study Of Solvent Effects On The Ground And Low-Lying Excited Free Energy Surfaces Of A Push-Pull Substituted Azobenzene
Pseudo-Cyclic Structures Of Mono- And Di-Azaderivatives Of Malondialdehydes. Synthesis And Conformational Disentanglement By Computational Analyses
Theoretical Study Of Solvent Effects On The Ground And Low-Lying Excited Free Energy Surfaces Of A Push-Pull Substituted Azobenzene
Pseudo-Cyclic Structures Of Mono- And Di-Azaderivatives Of Malondialdehydes. Synthesis And Conformational Disentanglement By Computational Analyses
Stepwise Formation Of 1,3-Diazolium-4-Thiolates By Münchnone Cycloadditions: Promising Candidates For Nonlinear Optics
Pseudo-Cyclic Structures Of Mono- And Di-Azaderivatives Of Malondialdehydes. Synthesis And Conformational Disentanglement By Computational Analyses
Stepwise Formation Of 1,3-Diazolium-4-Thiolates By Münchnone Cycloadditions: Promising Candidates For Nonlinear Optics
Hydrazones From Hydroxy Naphthaldehydes. Part 2. Condensations With Aromatic N-Aminoheterocycles And Elucidation Of Tautomeric Structures
Stepwise Formation Of 1,3-Diazolium-4-Thiolates By Münchnone Cycloadditions: Promising Candidates For Nonlinear Optics
Hydrazones From Hydroxy Naphthaldehydes. Part 2. Condensations With Aromatic N-Aminoheterocycles And Elucidation Of Tautomeric Structures
Glycerol: A Solvent And A Building Block Of Choice For Microwave And Ultrasound Irradiation Procedures
Hydrazones From Hydroxy Naphthaldehydes. Part 2. Condensations With Aromatic N-Aminoheterocycles And Elucidation Of Tautomeric Structures
Glycerol: A Solvent And A Building Block Of Choice For Microwave And Ultrasound Irradiation Procedures
Theoretical Kinetics Study Of The O(3p) + Ch4/cd 4 Hydrogen Abstraction Reaction: The Role Of Anharmonicity, Recrossing Effects, And Quantum Mechanical Tunneling
Glycerol: A Solvent And A Building Block Of Choice For Microwave And Ultrasound Irradiation Procedures
Theoretical Kinetics Study Of The O(3p) + Ch4/cd 4 Hydrogen Abstraction Reaction: The Role Of Anharmonicity, Recrossing Effects, And Quantum Mechanical Tunneling
The Hydrogen Abstraction Reaction O(3p) + Ch4: A New Analytical Potential Energy Surface Based On Fit To Ab Initio Calculations
Theoretical Kinetics Study Of The O(3p) + Ch4/cd 4 Hydrogen Abstraction Reaction: The Role Of Anharmonicity, Recrossing Effects, And Quantum Mechanical Tunneling
The Hydrogen Abstraction Reaction O(3p) + Ch4: A New Analytical Potential Energy Surface Based On Fit To Ab Initio Calculations
Theoretical Kinetics Study Of The F(2p) + Nh3 Hydrogen Abstraction Reaction
The Hydrogen Abstraction Reaction O(3p) + Ch4: A New Analytical Potential Energy Surface Based On Fit To Ab Initio Calculations
Theoretical Kinetics Study Of The F(2p) + Nh3 Hydrogen Abstraction Reaction
Non-Covalent Derivatization Of Aminosilanized Titanium Alloy Implants Silver-Enhanced Coating Of Antibacterial Organics
Theoretical Kinetics Study Of The F(2p) + Nh3 Hydrogen Abstraction Reaction
Non-Covalent Derivatization Of Aminosilanized Titanium Alloy Implants Silver-Enhanced Coating Of Antibacterial Organics
Rhodamine And Bodipy Chemodosimeters And Chemosensors For The Detection Of Hg2+, Based On Fluorescence Enhancement Effects
Non-Covalent Derivatization Of Aminosilanized Titanium Alloy Implants Silver-Enhanced Coating Of Antibacterial Organics
Rhodamine And Bodipy Chemodosimeters And Chemosensors For The Detection Of Hg2+, Based On Fluorescence Enhancement Effects
Photoinduced Electron Transfer Fluorometric Hg(Ii) Chemosensor Based On A Bodipy Armed With A Tetrapod Receptor
Rhodamine And Bodipy Chemodosimeters And Chemosensors For The Detection Of Hg2+, Based On Fluorescence Enhancement Effects
Photoinduced Electron Transfer Fluorometric Hg(Ii) Chemosensor Based On A Bodipy Armed With A Tetrapod Receptor
Theoretical Study Of The Conformational Equilibrium Of 1,4-Dioxane In Gas Phase, Neat Liquid, And Dilute Aqueous Solutions
Photoinduced Electron Transfer Fluorometric Hg(Ii) Chemosensor Based On A Bodipy Armed With A Tetrapod Receptor
Theoretical Study Of The Conformational Equilibrium Of 1,4-Dioxane In Gas Phase, Neat Liquid, And Dilute Aqueous Solutions
Microwave-Assisted Synthesis Of N-Heterocycles In Medicinal Chemistry
Theoretical Study Of The Conformational Equilibrium Of 1,4-Dioxane In Gas Phase, Neat Liquid, And Dilute Aqueous Solutions
Microwave-Assisted Synthesis Of N-Heterocycles In Medicinal Chemistry
Enantiomer-Specific Oriented Attachment: Formation Of Macroscopic Homochiral Crystal Aggregates From A Racemic System
Microwave-Assisted Synthesis Of N-Heterocycles In Medicinal Chemistry
Enantiomer-Specific Oriented Attachment: Formation Of Macroscopic Homochiral Crystal Aggregates From A Racemic System
On The Mechanochemical Activation By Ultrasound
Enantiomer-Specific Oriented Attachment: Formation Of Macroscopic Homochiral Crystal Aggregates From A Racemic System
On The Mechanochemical Activation By Ultrasound
Early History Of The Recognition Of Molecular Biochirality
On The Mechanochemical Activation By Ultrasound
Early History Of The Recognition Of Molecular Biochirality
The Combined Use Of Microwaves And Ultrasound: Methods And Practice
Early History Of The Recognition Of Molecular Biochirality
The Combined Use Of Microwaves And Ultrasound: Methods And Practice
Pharmaceutical And Nutraceutical Compounds From Natural Matrices
The Combined Use Of Microwaves And Ultrasound: Methods And Practice
Pharmaceutical And Nutraceutical Compounds From Natural Matrices
Co2 Vibrational State Distributions From Quasi-Classical Trajectory Studies Of The Ho + Co → H + Co2 Reaction And H + Co2 Inelastic Collision
Pharmaceutical And Nutraceutical Compounds From Natural Matrices
Co2 Vibrational State Distributions From Quasi-Classical Trajectory Studies Of The Ho + Co → H + Co2 Reaction And H + Co2 Inelastic Collision
Dynamics Study Of The Oh + Nh3 Hydrogen Abstraction Reaction Using Qct Calculations Based On An Analytical Potential Energy Surface
Co2 Vibrational State Distributions From Quasi-Classical Trajectory Studies Of The Ho + Co → H + Co2 Reaction And H + Co2 Inelastic Collision
Dynamics Study Of The Oh + Nh3 Hydrogen Abstraction Reaction Using Qct Calculations Based On An Analytical Potential Energy Surface
The Abstraction Reaction Of H And C-H Stretch Excited Chd3: A Qct Study On An Ab Initio Based Potential Energy Surface
Dynamics Study Of The Oh + Nh3 Hydrogen Abstraction Reaction Using Qct Calculations Based On An Analytical Potential Energy Surface
The Abstraction Reaction Of H And C-H Stretch Excited Chd3: A Qct Study On An Ab Initio Based Potential Energy Surface
Controlled Silanization-Amination Reactions On The Ti6al4v Surface For Biomedical Applications
The Abstraction Reaction Of H And C-H Stretch Excited Chd3: A Qct Study On An Ab Initio Based Potential Energy Surface
Controlled Silanization-Amination Reactions On The Ti6al4v Surface For Biomedical Applications
Complementary And Synergic Effects Of Microwaves And Ultrasound In Metal-Assisted Synthesis
Controlled Silanization-Amination Reactions On The Ti6al4v Surface For Biomedical Applications
Complementary And Synergic Effects Of Microwaves And Ultrasound In Metal-Assisted Synthesis
On The Physical Basis Of Asymmetry And Homochirality
Complementary And Synergic Effects Of Microwaves And Ultrasound In Metal-Assisted Synthesis
On The Physical Basis Of Asymmetry And Homochirality
Metrics: Allow More Gradual Progress
On The Physical Basis Of Asymmetry And Homochirality
Metrics: Allow More Gradual Progress
Merging Microfluidics And Sonochemistry: Towards Greener And More Efficient Micro-Sono-Reactors
Metrics: Allow More Gradual Progress
Merging Microfluidics And Sonochemistry: Towards Greener And More Efficient Micro-Sono-Reactors
On The Prebiotic Synthesis Of D-Sugars Catalyzed By L-Peptides: Assessments From First-Principles Calculations
Merging Microfluidics And Sonochemistry: Towards Greener And More Efficient Micro-Sono-Reactors
On The Prebiotic Synthesis Of D-Sugars Catalyzed By L-Peptides: Assessments From First-Principles Calculations
Comment On Enantiomer Resolution By Pressure Increase: Inferences From Experimental And Topological Results For The Binary Enantiomer System (R)- And (S)-Mandelic Acid
On The Prebiotic Synthesis Of D-Sugars Catalyzed By L-Peptides: Assessments From First-Principles Calculations
Comment On Enantiomer Resolution By Pressure Increase: Inferences From Experimental And Topological Results For The Binary Enantiomer System (R)- And (S)-Mandelic Acid
Enantioenrichment In Sublimed Amino Acid Mixtures
Comment On Enantiomer Resolution By Pressure Increase: Inferences From Experimental And Topological Results For The Binary Enantiomer System (R)- And (S)-Mandelic Acid
Enantioenrichment In Sublimed Amino Acid Mixtures
Mechanochemistry: Measuring The Force Of Sound
Enantioenrichment In Sublimed Amino Acid Mixtures
Mechanochemistry: Measuring The Force Of Sound
Harnessing Mechanochemical Effects With Ultrasound-Induced Reactions
Mechanochemistry: Measuring The Force Of Sound
Harnessing Mechanochemical Effects With Ultrasound-Induced Reactions
Fast And Reliable Location Of Stationary Points In A Reaction Path
Harnessing Mechanochemical Effects With Ultrasound-Induced Reactions
Fast And Reliable Location Of Stationary Points In A Reaction Path
Reticulated Pd(Ii)/cu(I) Cyclodextrin Complexes As Recyclable Green Catalyst For Sonogashira Alkynylation
Fast And Reliable Location Of Stationary Points In A Reaction Path
Reticulated Pd(Ii)/cu(I) Cyclodextrin Complexes As Recyclable Green Catalyst For Sonogashira Alkynylation
Analytical Potential Energy Surface For The Reaction With Intermediate Complexes Nh 3 + Cl → Nh 2 + Hcl: Application To The Kinetics Study
Reticulated Pd(Ii)/cu(I) Cyclodextrin Complexes As Recyclable Green Catalyst For Sonogashira Alkynylation
Analytical Potential Energy Surface For The Reaction With Intermediate Complexes Nh 3 + Cl → Nh 2 + Hcl: Application To The Kinetics Study
A Detailed Product Distribution Analysis Of Some Potential Energy Surfaces Describing The Oh+co→h+co 2 Reaction
Analytical Potential Energy Surface For The Reaction With Intermediate Complexes Nh 3 + Cl → Nh 2 + Hcl: Application To The Kinetics Study
A Detailed Product Distribution Analysis Of Some Potential Energy Surfaces Describing The Oh+co→h+co 2 Reaction
Quasi-Classical Trajectory Study Of The Role Of Vibrational And Translational Energy In The Cl( 2p) + Nh 3 Reaction
A Detailed Product Distribution Analysis Of Some Potential Energy Surfaces Describing The Oh+co→h+co 2 Reaction
Quasi-Classical Trajectory Study Of The Role Of Vibrational And Translational Energy In The Cl( 2p) + Nh 3 Reaction
Constructing Potential Energy Surfaces For Polyatomic Systems: Recent Progress And New Problems
Quasi-Classical Trajectory Study Of The Role Of Vibrational And Translational Energy In The Cl( 2p) + Nh 3 Reaction
Constructing Potential Energy Surfaces For Polyatomic Systems: Recent Progress And New Problems
Combined Ultrasound- Microwave Technologies
Constructing Potential Energy Surfaces For Polyatomic Systems: Recent Progress And New Problems
Combined Ultrasound- Microwave Technologies
Introduction To Sonochemistry: A Historical And Conceptual Overview
Combined Ultrasound- Microwave Technologies
Introduction To Sonochemistry: A Historical And Conceptual Overview
Theoretical Study Of The Role Of Solvent Stark Effect In Electron Transitions
Introduction To Sonochemistry: A Historical And Conceptual Overview
Theoretical Study Of The Role Of Solvent Stark Effect In Electron Transitions
Homochirality Beyond Grinding: Deracemizing Chiral Crystals By Temperature Gradient Under Boiling
Theoretical Study Of The Role Of Solvent Stark Effect In Electron Transitions
Homochirality Beyond Grinding: Deracemizing Chiral Crystals By Temperature Gradient Under Boiling
Tautomerism In Schiff Bases. The Cases Of 2-Hydroxy-1-Naphthaldehyde And 1-Hydroxy-2-Naphthaldehyde Investigated In Solution And The Solid State
Homochirality Beyond Grinding: Deracemizing Chiral Crystals By Temperature Gradient Under Boiling
Tautomerism In Schiff Bases. The Cases Of 2-Hydroxy-1-Naphthaldehyde And 1-Hydroxy-2-Naphthaldehyde Investigated In Solution And The Solid State
Asymmetric Amplification In Amino Acid Sublimation Involving Racemic Compound To Conglomerate Conversion
Tautomerism In Schiff Bases. The Cases Of 2-Hydroxy-1-Naphthaldehyde And 1-Hydroxy-2-Naphthaldehyde Investigated In Solution And The Solid State
Asymmetric Amplification In Amino Acid Sublimation Involving Racemic Compound To Conglomerate Conversion
On The Enhanced Reactivity And Selectivity Of Triazole Formation In Molecular Flasks. A Theoretical Rationale
Asymmetric Amplification In Amino Acid Sublimation Involving Racemic Compound To Conglomerate Conversion
On The Enhanced Reactivity And Selectivity Of Triazole Formation In Molecular Flasks. A Theoretical Rationale
A Bioinspired Look At The Glucosinolate Metabolic Pathway. Structural Insights Into The Reaction Of Benzyl Isothiocyanate And D-Glucosamine
On The Enhanced Reactivity And Selectivity Of Triazole Formation In Molecular Flasks. A Theoretical Rationale
A Bioinspired Look At The Glucosinolate Metabolic Pathway. Structural Insights Into The Reaction Of Benzyl Isothiocyanate And D-Glucosamine
On The Chiral Homogeneity Of Nature: From Atoms To Small Molecules
A Bioinspired Look At The Glucosinolate Metabolic Pathway. Structural Insights Into The Reaction Of Benzyl Isothiocyanate And D-Glucosamine
On The Chiral Homogeneity Of Nature: From Atoms To Small Molecules
Assessing Molecular Chirality With Twisted Light. Comment On Photochirogenesis: Photochemical Models On The Absolute Asymmetric Formation Of Amino Acids In Interstellar Space By Uwe J. Meierhenrich Et Al.
On The Chiral Homogeneity Of Nature: From Atoms To Small Molecules
Assessing Molecular Chirality With Twisted Light. Comment On Photochirogenesis: Photochemical Models On The Absolute Asymmetric Formation Of Amino Acids In Interstellar Space By Uwe J. Meierhenrich Et Al.
Schiff Bases From Tris And Ortho-Hydroxyarenecarbaldehydes: Structures And Tautomeric Equilibria In The Solid State And In Solution
Assessing Molecular Chirality With Twisted Light. Comment On Photochirogenesis: Photochemical Models On The Absolute Asymmetric Formation Of Amino Acids In Interstellar Space By Uwe J. Meierhenrich Et Al.
Schiff Bases From Tris And Ortho-Hydroxyarenecarbaldehydes: Structures And Tautomeric Equilibria In The Solid State And In Solution
A Quantitative Structure-Reactivity Relationship In N-Acetyl Oxazolidines: An Electrostatic Interaction Controls Rotamer Population
Schiff Bases From Tris And Ortho-Hydroxyarenecarbaldehydes: Structures And Tautomeric Equilibria In The Solid State And In Solution
A Quantitative Structure-Reactivity Relationship In N-Acetyl Oxazolidines: An Electrostatic Interaction Controls Rotamer Population
Assessing The Whole Range Of Cuaac Mechanisms By Dft Calculations - On The Intermediacy Of Copper Acetylides
A Quantitative Structure-Reactivity Relationship In N-Acetyl Oxazolidines: An Electrostatic Interaction Controls Rotamer Population
Assessing The Whole Range Of Cuaac Mechanisms By Dft Calculations - On The Intermediacy Of Copper Acetylides
Hydrazones From Hydroxy Naphthaldehydes And N-Aminoheterocycles: Structure And Stereodynamics
Assessing The Whole Range Of Cuaac Mechanisms By Dft Calculations - On The Intermediacy Of Copper Acetylides
Hydrazones From Hydroxy Naphthaldehydes And N-Aminoheterocycles: Structure And Stereodynamics
Assessing Performance Through Understanding
Hydrazones From Hydroxy Naphthaldehydes And N-Aminoheterocycles: Structure And Stereodynamics
Assessing Performance Through Understanding
Power Ultrasound In Metal-Assisted Synthesis: From Classical Barbier-Like Reactions To Click Chemistry
Assessing Performance Through Understanding
Power Ultrasound In Metal-Assisted Synthesis: From Classical Barbier-Like Reactions To Click Chemistry
Kinetics And Dynamics Study Of The H + Ccl4 → Hcl(V′, J′) + Ccl3 Reaction
Power Ultrasound In Metal-Assisted Synthesis: From Classical Barbier-Like Reactions To Click Chemistry
Kinetics And Dynamics Study Of The H + Ccl4 → Hcl(V′, J′) + Ccl3 Reaction
Classical Versus Quantum Vibrational State Distributions For The Benchmark Polyatomic Reaction Oh + D2: Checking The Validity Of The Qct Method
Kinetics And Dynamics Study Of The H + Ccl4 → Hcl(V′, J′) + Ccl3 Reaction
Classical Versus Quantum Vibrational State Distributions For The Benchmark Polyatomic Reaction Oh + D2: Checking The Validity Of The Qct Method
Kinetics And Dynamics Of The Nh3 H → Nh2 H 2 Reaction Using Transition State Methods, Quasi-Classical Trajectories, And Quantum-Mechanical Scattering
Classical Versus Quantum Vibrational State Distributions For The Benchmark Polyatomic Reaction Oh + D2: Checking The Validity Of The Qct Method
Kinetics And Dynamics Of The Nh3 H → Nh2 H 2 Reaction Using Transition State Methods, Quasi-Classical Trajectories, And Quantum-Mechanical Scattering
Push-Pull 1,3-Thiazolium-5-Thiolates. Formation Via Concerted And Stepwise Pathways, And Theoretical Evaluation Of Nlo Properties
Kinetics And Dynamics Of The Nh3 H → Nh2 H 2 Reaction Using Transition State Methods, Quasi-Classical Trajectories, And Quantum-Mechanical Scattering
Push-Pull 1,3-Thiazolium-5-Thiolates. Formation Via Concerted And Stepwise Pathways, And Theoretical Evaluation Of Nlo Properties
Schiff Bases From Tris And Formylpyridines: Structure And Mechanistic Rationale Aided By Dft Calculations
Push-Pull 1,3-Thiazolium-5-Thiolates. Formation Via Concerted And Stepwise Pathways, And Theoretical Evaluation Of Nlo Properties
Schiff Bases From Tris And Formylpyridines: Structure And Mechanistic Rationale Aided By Dft Calculations
An Anomeric Effect Drives The Regiospecific Ring-Opening Of 1,3-Oxazolidines Under Acetylating Conditions
Schiff Bases From Tris And Formylpyridines: Structure And Mechanistic Rationale Aided By Dft Calculations
An Anomeric Effect Drives The Regiospecific Ring-Opening Of 1,3-Oxazolidines Under Acetylating Conditions
Reconfiguration Of Stereoisomers Under Sonomechanical Activation
An Anomeric Effect Drives The Regiospecific Ring-Opening Of 1,3-Oxazolidines Under Acetylating Conditions
Reconfiguration Of Stereoisomers Under Sonomechanical Activation
Metrics: Include Refereeing As Part Of Performance Rating
Reconfiguration Of Stereoisomers Under Sonomechanical Activation
Metrics: Include Refereeing As Part Of Performance Rating
Unusual Aryl Migration In A Mesomeric Betaine In The Solid And Liquid State: Mechanistic Insights Into The Snar Reaction
Metrics: Include Refereeing As Part Of Performance Rating
Unusual Aryl Migration In A Mesomeric Betaine In The Solid And Liquid State: Mechanistic Insights Into The Snar Reaction
Homochirality And Chemical Evolution: New Vistas And Reflections On Recent Models
Unusual Aryl Migration In A Mesomeric Betaine In The Solid And Liquid State: Mechanistic Insights Into The Snar Reaction
Homochirality And Chemical Evolution: New Vistas And Reflections On Recent Models
Sonication-Assisted Fabrication And Post-Synthetic Modifications Of Graphene-Like Materials
Homochirality And Chemical Evolution: New Vistas And Reflections On Recent Models
Sonication-Assisted Fabrication And Post-Synthetic Modifications Of Graphene-Like Materials
Alkyne-Azide Click Reaction Catalyzed By Metallic Copper Under Ultrasound
Sonication-Assisted Fabrication And Post-Synthetic Modifications Of Graphene-Like Materials
Alkyne-Azide Click Reaction Catalyzed By Metallic Copper Under Ultrasound
A New Model For Mapping The Peptide Backbone: Predicting Proton Chemical Shifts In Proteins
Alkyne-Azide Click Reaction Catalyzed By Metallic Copper Under Ultrasound
A New Model For Mapping The Peptide Backbone: Predicting Proton Chemical Shifts In Proteins
Schiff Bases From D-Glucosamine And Aliphatic Ketones
A New Model For Mapping The Peptide Backbone: Predicting Proton Chemical Shifts In Proteins
Schiff Bases From D-Glucosamine And Aliphatic Ketones
A New Pilot Flow Reactor For High-Intensity Ultrasound Irradiation. Application To The Synthesis Of Biodiesel
Schiff Bases From D-Glucosamine And Aliphatic Ketones
A New Pilot Flow Reactor For High-Intensity Ultrasound Irradiation. Application To The Synthesis Of Biodiesel
Evolving Alchemy Into Chemistry: No Longer A Dichotomy
A New Pilot Flow Reactor For High-Intensity Ultrasound Irradiation. Application To The Synthesis Of Biodiesel
Evolving Alchemy Into Chemistry: No Longer A Dichotomy
Quasi-Classical Trajectory Calculations Of The Hydrogen Abstraction Reaction H + Nh3
Evolving Alchemy Into Chemistry: No Longer A Dichotomy
Quasi-Classical Trajectory Calculations Of The Hydrogen Abstraction Reaction H + Nh3
Classical Description In A Quantum Spirit Of The Prototype Four-Atom Reaction Oh + D2
Quasi-Classical Trajectory Calculations Of The Hydrogen Abstraction Reaction H + Nh3
Classical Description In A Quantum Spirit Of The Prototype Four-Atom Reaction Oh + D2
Analytical Potential Energy Surface And Kinetics Of The Nh3 + H -Nh2 + H2 Hydrogen Abstraction And The Ammonia Inversion Reactions
Classical Description In A Quantum Spirit Of The Prototype Four-Atom Reaction Oh + D2
Analytical Potential Energy Surface And Kinetics Of The Nh3 + H -Nh2 + H2 Hydrogen Abstraction And The Ammonia Inversion Reactions
The Hydrogen Abstraction Reaction H+ Ch4. I. New Analytical Potential Energy Surface Based On Fitting To Ab Initio Calculations
Analytical Potential Energy Surface And Kinetics Of The Nh3 + H -Nh2 + H2 Hydrogen Abstraction And The Ammonia Inversion Reactions
The Hydrogen Abstraction Reaction H+ Ch4. I. New Analytical Potential Energy Surface Based On Fitting To Ab Initio Calculations
Dissecting Competitive Mechanisms: Thionation Vs. Cycloaddition In The Reaction Of Thioisomünchnones With Isothiocyanates Under Microwave Irradiation
The Hydrogen Abstraction Reaction H+ Ch4. I. New Analytical Potential Energy Surface Based On Fitting To Ab Initio Calculations
Dissecting Competitive Mechanisms: Thionation Vs. Cycloaddition In The Reaction Of Thioisomünchnones With Isothiocyanates Under Microwave Irradiation
Molecular Self-Assembly And Patterning Induced By Sound Waves. The Case Of Gelation
Dissecting Competitive Mechanisms: Thionation Vs. Cycloaddition In The Reaction Of Thioisomünchnones With Isothiocyanates Under Microwave Irradiation
Molecular Self-Assembly And Patterning Induced By Sound Waves. The Case Of Gelation
Thionation Of Mesoionics With Isothiocyanates: Evidence Supporting A Four-Step Domino Process And Ruling Out A [2 + 2] Mechanism
Molecular Self-Assembly And Patterning Induced By Sound Waves. The Case Of Gelation
Thionation Of Mesoionics With Isothiocyanates: Evidence Supporting A Four-Step Domino Process And Ruling Out A [2 + 2] Mechanism
Product Vibrational Distributions In Polyatomic Species Based On Quasiclassical Trajectory Calculations
Thionation Of Mesoionics With Isothiocyanates: Evidence Supporting A Four-Step Domino Process And Ruling Out A [2 + 2] Mechanism
Product Vibrational Distributions In Polyatomic Species Based On Quasiclassical Trajectory Calculations
The Hydrogen Abstraction Reaction H+ Ch4. Ii. Theoretical Investigation Of The Kinetics And Dynamics
Product Vibrational Distributions In Polyatomic Species Based On Quasiclassical Trajectory Calculations
The Hydrogen Abstraction Reaction H+ Ch4. Ii. Theoretical Investigation Of The Kinetics And Dynamics
Transition Metals In Radiation-Induced Reactions For Organic Synthesis: Applications Of Ultrasound
The Hydrogen Abstraction Reaction H+ Ch4. Ii. Theoretical Investigation Of The Kinetics And Dynamics
Transition Metals In Radiation-Induced Reactions For Organic Synthesis: Applications Of Ultrasound
Pd-Catalyzed Reactions Promoted By Ultrasound And/or Microwave Irradiation
Transition Metals In Radiation-Induced Reactions For Organic Synthesis: Applications Of Ultrasound
Pd-Catalyzed Reactions Promoted By Ultrasound And/or Microwave Irradiation
On Cavitation And Chirality: A Further Assessment
Pd-Catalyzed Reactions Promoted By Ultrasound And/or Microwave Irradiation
On Cavitation And Chirality: A Further Assessment
An Efficient And Highly Diastereoselective Synthesis Of C-Glycosylated 1,3-Oxazolidines From N-Methyl-D-Glucamine
On Cavitation And Chirality: A Further Assessment
An Efficient And Highly Diastereoselective Synthesis Of C-Glycosylated 1,3-Oxazolidines From N-Methyl-D-Glucamine
A Family Of Hydrogels Based On Ureido-Linked Aminopolyol-Derived Amphiphiles And Bolaamphiphiles: Synthesis, Gelation Under Thermal And Sonochemical Stimuli, And Mesomorphic Characterization
An Efficient And Highly Diastereoselective Synthesis Of C-Glycosylated 1,3-Oxazolidines From N-Methyl-D-Glucamine
A Family Of Hydrogels Based On Ureido-Linked Aminopolyol-Derived Amphiphiles And Bolaamphiphiles: Synthesis, Gelation Under Thermal And Sonochemical Stimuli, And Mesomorphic Characterization
Sublime Arguments: Rethinking The Generation Of Homochirality Under Prebiotic Conditions
A Family Of Hydrogels Based On Ureido-Linked Aminopolyol-Derived Amphiphiles And Bolaamphiphiles: Synthesis, Gelation Under Thermal And Sonochemical Stimuli, And Mesomorphic Characterization
Sublime Arguments: Rethinking The Generation Of Homochirality Under Prebiotic Conditions
Stepwise Cycloadditions Of Mesoionic Systems: Thionation Of Thioisomunchnones By Isothiocyanates
Sublime Arguments: Rethinking The Generation Of Homochirality Under Prebiotic Conditions
Stepwise Cycloadditions Of Mesoionic Systems: Thionation Of Thioisomunchnones By Isothiocyanates
Chiral N-Acyloxazolidines: Synthesis, Structure, And Mechanistic Insights
Stepwise Cycloadditions Of Mesoionic Systems: Thionation Of Thioisomunchnones By Isothiocyanates
Chiral N-Acyloxazolidines: Synthesis, Structure, And Mechanistic Insights
Improved Extraction Of Vegetable Oils Under High-Intensity Ultrasound And/or Microwaves
Chiral N-Acyloxazolidines: Synthesis, Structure, And Mechanistic Insights
Improved Extraction Of Vegetable Oils Under High-Intensity Ultrasound And/or Microwaves
Chirality And Chemical Processes: A Few Afterthoughts
Improved Extraction Of Vegetable Oils Under High-Intensity Ultrasound And/or Microwaves
Chirality And Chemical Processes: A Few Afterthoughts
Quasi-Classical Trajectory Calculations In Asymmetrically Substituted Polyatomic Systems Of The Type A + Cx3y → Products: The H + Ch3cl Hydrogen Abstraction Reaction Channel
Chirality And Chemical Processes: A Few Afterthoughts
Quasi-Classical Trajectory Calculations In Asymmetrically Substituted Polyatomic Systems Of The Type A + Cx3y → Products: The H + Ch3cl Hydrogen Abstraction Reaction Channel
Ultrasound-Induced Activation Of Metals: Principles And Applications In Organic Synthesis
Quasi-Classical Trajectory Calculations In Asymmetrically Substituted Polyatomic Systems Of The Type A + Cx3y → Products: The H + Ch3cl Hydrogen Abstraction Reaction Channel
Ultrasound-Induced Activation Of Metals: Principles And Applications In Organic Synthesis
Sonochemistry
Ultrasound-Induced Activation Of Metals: Principles And Applications In Organic Synthesis
Sonochemistry
Chemical Reaction To The Many-Worlds Hypothesis [3]
Sonochemistry
Chemical Reaction To The Many-Worlds Hypothesis [3]
Improved Protocols For Microwave-Assisted Cu(I)-Catalyzed Huisgen 1,3-Dipolar Cycloadditions
Chemical Reaction To The Many-Worlds Hypothesis [3]
Improved Protocols For Microwave-Assisted Cu(I)-Catalyzed Huisgen 1,3-Dipolar Cycloadditions
Forcing And Controlling Chemical Reactions With Ultrasound
Improved Protocols For Microwave-Assisted Cu(I)-Catalyzed Huisgen 1,3-Dipolar Cycloadditions
Forcing And Controlling Chemical Reactions With Ultrasound
Tracing The Origins And Evolution Of Chirality And Handedness In Chemical Language
Forcing And Controlling Chemical Reactions With Ultrasound
Tracing The Origins And Evolution Of Chirality And Handedness In Chemical Language
The Combined Use Of Microwaves And Ultrasound: Improved Tools In Process Chemistry And Organic Synthesis
Tracing The Origins And Evolution Of Chirality And Handedness In Chemical Language
The Combined Use Of Microwaves And Ultrasound: Improved Tools In Process Chemistry And Organic Synthesis
Extraction Of Flavourings From Natural Sources
The Combined Use Of Microwaves And Ultrasound: Improved Tools In Process Chemistry And Organic Synthesis
Extraction Of Flavourings From Natural Sources
Enhanced Diels-Alder Reactions: On The Role Of Mineral Catalysts And Microwave Irradiation In Ionic Liquids As Recyclable Media
Extraction Of Flavourings From Natural Sources
Enhanced Diels-Alder Reactions: On The Role Of Mineral Catalysts And Microwave Irradiation In Ionic Liquids As Recyclable Media
Seven Dimensional Quantum Dynamics Study Of The H2 +n H2 →h+n H3 Reaction
Enhanced Diels-Alder Reactions: On The Role Of Mineral Catalysts And Microwave Irradiation In Ionic Liquids As Recyclable Media
Seven Dimensional Quantum Dynamics Study Of The H2 +n H2 →h+n H3 Reaction
Seven-Dimensional Quantum Dynamics Study Of The H+nh3 → H2+nh2 Reaction
Seven Dimensional Quantum Dynamics Study Of The H2 +n H2 →h+n H3 Reaction
Seven-Dimensional Quantum Dynamics Study Of The H+nh3 → H2+nh2 Reaction
On The Reactivity Of 2-Alkyl-1,3-Thiazolium-4-Olates Toward Electrophiles
Seven-Dimensional Quantum Dynamics Study Of The H+nh3 → H2+nh2 Reaction
On The Reactivity Of 2-Alkyl-1,3-Thiazolium-4-Olates Toward Electrophiles
Construction Of C-Nucleosides Diversified By [3+2] Cycloaddition From A Sugar-Based Mesoionic Ring
On The Reactivity Of 2-Alkyl-1,3-Thiazolium-4-Olates Toward Electrophiles
Construction Of C-Nucleosides Diversified By [3+2] Cycloaddition From A Sugar-Based Mesoionic Ring
Greener Media In Chemical Synthesis And Processing
Construction Of C-Nucleosides Diversified By [3+2] Cycloaddition From A Sugar-Based Mesoionic Ring
Greener Media In Chemical Synthesis And Processing
A One-Pot Domino Reaction In Constructing Isoorotate Bases And Their Nucleosides
Greener Media In Chemical Synthesis And Processing
A One-Pot Domino Reaction In Constructing Isoorotate Bases And Their Nucleosides
Synthesis Of Sugar Isocyanates And Their Application To The Formation Of Ureido-Linked Disaccharides
A One-Pot Domino Reaction In Constructing Isoorotate Bases And Their Nucleosides
Synthesis Of Sugar Isocyanates And Their Application To The Formation Of Ureido-Linked Disaccharides
Power Ultrasound In Organic Synthesis: Moving Cavitational Chemistry From Academia To Innovative And Large-Scale Applications
Synthesis Of Sugar Isocyanates And Their Application To The Formation Of Ureido-Linked Disaccharides
Power Ultrasound In Organic Synthesis: Moving Cavitational Chemistry From Academia To Innovative And Large-Scale Applications
Sonochemical Cycloadditions In Ionic Liquids. Lessons From Model Cases Involving Common Dienes And Carbonyl Dienophiles
Power Ultrasound In Organic Synthesis: Moving Cavitational Chemistry From Academia To Innovative And Large-Scale Applications
Sonochemical Cycloadditions In Ionic Liquids. Lessons From Model Cases Involving Common Dienes And Carbonyl Dienophiles
Importance Of Anharmonicity, Recrossing Effects, And Quantum Mechanical Tunneling In Transition State Theory With Semiclassical Tunneling. A Test Case: The H2 + Ci Hydrogen Abstraction Reaction
Sonochemical Cycloadditions In Ionic Liquids. Lessons From Model Cases Involving Common Dienes And Carbonyl Dienophiles
Importance Of Anharmonicity, Recrossing Effects, And Quantum Mechanical Tunneling In Transition State Theory With Semiclassical Tunneling. A Test Case: The H2 + Ci Hydrogen Abstraction Reaction
Product Angular Distribution For The H + Cd4 → Hd + Cd 3 Reaction
Importance Of Anharmonicity, Recrossing Effects, And Quantum Mechanical Tunneling In Transition State Theory With Semiclassical Tunneling. A Test Case: The H2 + Ci Hydrogen Abstraction Reaction
Product Angular Distribution For The H + Cd4 → Hd + Cd 3 Reaction
Quasi-Classical Trajectory Calculations Analyzing The Reactivity And Dynamics Of Asymmetric Stretch Mode Excitations Of Methane In The H + Ch 4 Reaction
Product Angular Distribution For The H + Cd4 → Hd + Cd 3 Reaction
Quasi-Classical Trajectory Calculations Analyzing The Reactivity And Dynamics Of Asymmetric Stretch Mode Excitations Of Methane In The H + Ch 4 Reaction
Quasi-Classical Trajectory Calculations Analyzing The Role Of Bending Mode Excitations Of Methane In The Cl + Ch4 Reaction
Quasi-Classical Trajectory Calculations Analyzing The Reactivity And Dynamics Of Asymmetric Stretch Mode Excitations Of Methane In The H + Ch 4 Reaction
Quasi-Classical Trajectory Calculations Analyzing The Role Of Bending Mode Excitations Of Methane In The Cl + Ch4 Reaction
Potential Energy Surface, Kinetics, And Dynamics Study Of The Cl+c H 4 →hcl+c H3 Reaction
Quasi-Classical Trajectory Calculations Analyzing The Role Of Bending Mode Excitations Of Methane In The Cl + Ch4 Reaction
Potential Energy Surface, Kinetics, And Dynamics Study Of The Cl+c H 4 →hcl+c H3 Reaction
Quasiclassical Trajectory Calculations Comparing The Reactivity And Dynamics Of Symmetric And Asymmetric Stretch And The Role Of The Bending Mode Excitations Of Methane In The Cl+ch4 Reaction
Potential Energy Surface, Kinetics, And Dynamics Study Of The Cl+c H 4 →hcl+c H3 Reaction
Quasiclassical Trajectory Calculations Comparing The Reactivity And Dynamics Of Symmetric And Asymmetric Stretch And The Role Of The Bending Mode Excitations Of Methane In The Cl+ch4 Reaction
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 4: Absolute Stereochemistry Of Carbohydrate-Based Imidazolidine-2-Ones And 2-Thiones With Axial And Central Chirality
Quasiclassical Trajectory Calculations Comparing The Reactivity And Dynamics Of Symmetric And Asymmetric Stretch And The Role Of The Bending Mode Excitations Of Methane In The Cl+ch4 Reaction
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 4: Absolute Stereochemistry Of Carbohydrate-Based Imidazolidine-2-Ones And 2-Thiones With Axial And Central Chirality
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 3: Rotational Isomerism Of Sterically Hindered Heteroaryl Imidazolidine-2-Ones And 2-Thiones
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 4: Absolute Stereochemistry Of Carbohydrate-Based Imidazolidine-2-Ones And 2-Thiones With Axial And Central Chirality
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 3: Rotational Isomerism Of Sterically Hindered Heteroaryl Imidazolidine-2-Ones And 2-Thiones
Exploiting Synthetic Chemistry With Mesoionic Rings: Improvements Achieved With Thioisomünchnones
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 3: Rotational Isomerism Of Sterically Hindered Heteroaryl Imidazolidine-2-Ones And 2-Thiones
Exploiting Synthetic Chemistry With Mesoionic Rings: Improvements Achieved With Thioisomünchnones
Ultrasonics Sonochemistry: Preface
Exploiting Synthetic Chemistry With Mesoionic Rings: Improvements Achieved With Thioisomünchnones
Ultrasonics Sonochemistry: Preface
Starting From Scratch: The Rise And Fate Of Carbon Atoms
Ultrasonics Sonochemistry: Preface
Starting From Scratch: The Rise And Fate Of Carbon Atoms
Chemistry And Luminescence
Starting From Scratch: The Rise And Fate Of Carbon Atoms
Chemistry And Luminescence
Theoretical Study Of The Antioxidant Activity Of Vitamin E: Reactions Of Α-Tocopherol With The Hydroperoxy Radical
Chemistry And Luminescence
Theoretical Study Of The Antioxidant Activity Of Vitamin E: Reactions Of Α-Tocopherol With The Hydroperoxy Radical
On The Accuracy Of An Analytical Potential Energy Surface For The Ch 4 + Cl Reaction And The Quasi-Classical Trajectory Calculations For Thermal Rate Constants
Theoretical Study Of The Antioxidant Activity Of Vitamin E: Reactions Of Α-Tocopherol With The Hydroperoxy Radical
On The Accuracy Of An Analytical Potential Energy Surface For The Ch 4 + Cl Reaction And The Quasi-Classical Trajectory Calculations For Thermal Rate Constants
Trapping Of The Oh Radical By Α-Tocopherol: A Theoretical Study
On The Accuracy Of An Analytical Potential Energy Surface For The Ch 4 + Cl Reaction And The Quasi-Classical Trajectory Calculations For Thermal Rate Constants
Trapping Of The Oh Radical By Α-Tocopherol: A Theoretical Study
Theoretical Study Of The Relative Stability Of Rotational Conformers Of Α And Β-D-Glucopyranose In Gas Phase And Aqueous Solution
Trapping Of The Oh Radical By Α-Tocopherol: A Theoretical Study
Theoretical Study Of The Relative Stability Of Rotational Conformers Of Α And Β-D-Glucopyranose In Gas Phase And Aqueous Solution
Non-Dipolar Behavior Of Mesoionic Heterocycles: Synthesis And Tautomerism Of 2-Alkylthioisomünchnones
Theoretical Study Of The Relative Stability Of Rotational Conformers Of Α And Β-D-Glucopyranose In Gas Phase And Aqueous Solution
Non-Dipolar Behavior Of Mesoionic Heterocycles: Synthesis And Tautomerism Of 2-Alkylthioisomünchnones
The Road To Chemical Names And Eponyms: Discovery, Priority, And Credit
Non-Dipolar Behavior Of Mesoionic Heterocycles: Synthesis And Tautomerism Of 2-Alkylthioisomünchnones
The Road To Chemical Names And Eponyms: Discovery, Priority, And Credit
Symmetry Breaking: An Epistemological Note
The Road To Chemical Names And Eponyms: Discovery, Priority, And Credit
Symmetry Breaking: An Epistemological Note
Symmetry Breaking By Spontaneous Crystallization - Is It The Most Plausible Source Of Terrestrial Handedness We Have Long Been Looking For? - A Reappraisal
Symmetry Breaking: An Epistemological Note
Symmetry Breaking By Spontaneous Crystallization - Is It The Most Plausible Source Of Terrestrial Handedness We Have Long Been Looking For? - A Reappraisal
Evolutionary Biology And Chemical Geology: A Timely Marriage
Symmetry Breaking By Spontaneous Crystallization - Is It The Most Plausible Source Of Terrestrial Handedness We Have Long Been Looking For? - A Reappraisal
Evolutionary Biology And Chemical Geology: A Timely Marriage
Confidential Reports May Improve Peer Review [3]
Evolutionary Biology And Chemical Geology: A Timely Marriage
Confidential Reports May Improve Peer Review [3]
Erratum: Thermal And Sonochemical Studies On The Diels-Alder Cycloadditions Of Masked O-Benzoquinones With Furans: New Insights Into The Reaction Mechanism (Journal Of Organic Chemistry (2003) 68 (7193-7203))
Confidential Reports May Improve Peer Review [3]
Erratum: Thermal And Sonochemical Studies On The Diels-Alder Cycloadditions Of Masked O-Benzoquinones With Furans: New Insights Into The Reaction Mechanism (Journal Of Organic Chemistry (2003) 68 (7193-7203))
Ensemble-Averaged Variational Transition State Theory With Optimized Multidimensional Tunneling For Enzyme Kinetics And Other Condensed-Phase Reactions
Erratum: Thermal And Sonochemical Studies On The Diels-Alder Cycloadditions Of Masked O-Benzoquinones With Furans: New Insights Into The Reaction Mechanism (Journal Of Organic Chemistry (2003) 68 (7193-7203))
Ensemble-Averaged Variational Transition State Theory With Optimized Multidimensional Tunneling For Enzyme Kinetics And Other Condensed-Phase Reactions
New Hybrid Method For Reactive Systems From Integrating Molecular Orbital Or Molecular Mechanics Methods With Analytical Potential Energy Surfaces
Ensemble-Averaged Variational Transition State Theory With Optimized Multidimensional Tunneling For Enzyme Kinetics And Other Condensed-Phase Reactions
New Hybrid Method For Reactive Systems From Integrating Molecular Orbital Or Molecular Mechanics Methods With Analytical Potential Energy Surfaces
Mechanism And Kinetics Of The N-Propyl Bromide And Oh Reaction Using Integrated Ab Initio Methods And Variational Transition-State Theory
New Hybrid Method For Reactive Systems From Integrating Molecular Orbital Or Molecular Mechanics Methods With Analytical Potential Energy Surfaces
Mechanism And Kinetics Of The N-Propyl Bromide And Oh Reaction Using Integrated Ab Initio Methods And Variational Transition-State Theory
Erratum: Potlib 2001: A Potential Energy Surface Library For Chemical Systems (Computer Physics Communications (2002) 144 (169-187))
Mechanism And Kinetics Of The N-Propyl Bromide And Oh Reaction Using Integrated Ab Initio Methods And Variational Transition-State Theory
Erratum: Potlib 2001: A Potential Energy Surface Library For Chemical Systems (Computer Physics Communications (2002) 144 (169-187))
Reactivity Of 2-Methyl Thioisomünchnone With Acid Chlorides
Erratum: Potlib 2001: A Potential Energy Surface Library For Chemical Systems (Computer Physics Communications (2002) 144 (169-187))
Reactivity Of 2-Methyl Thioisomünchnone With Acid Chlorides
Thermal And Sonochemical Studies On The Diels-Alder Cycloadditions Of Masked O-Benzoquinones With Furans: New Insights Into The Reaction Mechanism
Reactivity Of 2-Methyl Thioisomünchnone With Acid Chlorides
Thermal And Sonochemical Studies On The Diels-Alder Cycloadditions Of Masked O-Benzoquinones With Furans: New Insights Into The Reaction Mechanism
1,3-Dipolar Cycloaddition Of 2-Dialkylaminothioisomünchnones With Aliphatic Aldehydes: Synthesis Of Β-Lactams And Thiiranes, Structure Elucidation, And Rationale For Chemoselective Fragmentation Of Cycloadducts
Thermal And Sonochemical Studies On The Diels-Alder Cycloadditions Of Masked O-Benzoquinones With Furans: New Insights Into The Reaction Mechanism
1,3-Dipolar Cycloaddition Of 2-Dialkylaminothioisomünchnones With Aliphatic Aldehydes: Synthesis Of Β-Lactams And Thiiranes, Structure Elucidation, And Rationale For Chemoselective Fragmentation Of Cycloadducts
Conformation Of Secondary Amides. A Predictive Algorithm That Correlates Dft-Calculated Structures And Experimental Proton Chemical Shifts
1,3-Dipolar Cycloaddition Of 2-Dialkylaminothioisomünchnones With Aliphatic Aldehydes: Synthesis Of Β-Lactams And Thiiranes, Structure Elucidation, And Rationale For Chemoselective Fragmentation Of Cycloadducts
Conformation Of Secondary Amides. A Predictive Algorithm That Correlates Dft-Calculated Structures And Experimental Proton Chemical Shifts
Sonochemical Effects In The Additions Of Furan To Masked Ortho-Benzoquinones
Conformation Of Secondary Amides. A Predictive Algorithm That Correlates Dft-Calculated Structures And Experimental Proton Chemical Shifts
Sonochemical Effects In The Additions Of Furan To Masked Ortho-Benzoquinones
What Does Elementary Chirality Have To Do With Neutrinos?
Sonochemical Effects In The Additions Of Furan To Masked Ortho-Benzoquinones
What Does Elementary Chirality Have To Do With Neutrinos?
How Serendipity Led To An Early Treatment [2]
What Does Elementary Chirality Have To Do With Neutrinos?
How Serendipity Led To An Early Treatment [2]
Erratum: (Angewandte Chemie - International Edition (2002) 7 (1139-1145))
How Serendipity Led To An Early Treatment [2]
Erratum: (Angewandte Chemie - International Edition (2002) 7 (1139-1145))
Experimental And Theoretical Insights Regarding The Cycloaddition Reaction Of Carbohydrate-Based 1,2-Diaza-1,3-Butadienes And Acrylonitrile. A Model Case For The Behavior Of Chiral Azoalkenes And Unsymmetric Olefins
Erratum: (Angewandte Chemie - International Edition (2002) 7 (1139-1145))
Experimental And Theoretical Insights Regarding The Cycloaddition Reaction Of Carbohydrate-Based 1,2-Diaza-1,3-Butadienes And Acrylonitrile. A Model Case For The Behavior Of Chiral Azoalkenes And Unsymmetric Olefins
Novel Acid-Catalyzed Rearrangement Of Tetrahydro-1,2,3,4-Tetrazines: Unexpected Formation Of Glycosazones
Experimental And Theoretical Insights Regarding The Cycloaddition Reaction Of Carbohydrate-Based 1,2-Diaza-1,3-Butadienes And Acrylonitrile. A Model Case For The Behavior Of Chiral Azoalkenes And Unsymmetric Olefins
Novel Acid-Catalyzed Rearrangement Of Tetrahydro-1,2,3,4-Tetrazines: Unexpected Formation Of Glycosazones
Chirality Of Living Systems: A Helping Hand From Crystals And Oligopeptides
Novel Acid-Catalyzed Rearrangement Of Tetrahydro-1,2,3,4-Tetrazines: Unexpected Formation Of Glycosazones
Chirality Of Living Systems: A Helping Hand From Crystals And Oligopeptides
Generation And Fate Of A Novel Homochiral Mesoionic Dipole: Synthesis Of C-Nucleoside Analogs
Chirality Of Living Systems: A Helping Hand From Crystals And Oligopeptides
Generation And Fate Of A Novel Homochiral Mesoionic Dipole: Synthesis Of C-Nucleoside Analogs
The Incorporation Of Quantum Effects In Enzyme Kinetics Modeling
Generation And Fate Of A Novel Homochiral Mesoionic Dipole: Synthesis Of C-Nucleoside Analogs
The Incorporation Of Quantum Effects In Enzyme Kinetics Modeling
Erratum: Quantum Mechanical Tunneling In Methylamine Dehydrogenase (Chemical Physics Letters (2001) 347 (512-518) Pii: S0009261401009216)
The Incorporation Of Quantum Effects In Enzyme Kinetics Modeling
Erratum: Quantum Mechanical Tunneling In Methylamine Dehydrogenase (Chemical Physics Letters (2001) 347 (512-518) Pii: S0009261401009216)
Interpolated Algorithm For Large-Curvature Tunneling Calculations Of Transmission Coefficients For Variational Transition State Theory Calculations Of Reaction Rates
Erratum: Quantum Mechanical Tunneling In Methylamine Dehydrogenase (Chemical Physics Letters (2001) 347 (512-518) Pii: S0009261401009216)
Interpolated Algorithm For Large-Curvature Tunneling Calculations Of Transmission Coefficients For Variational Transition State Theory Calculations Of Reaction Rates
Potlib 2001: A Potential Energy Surface Library For Chemical Systems
Interpolated Algorithm For Large-Curvature Tunneling Calculations Of Transmission Coefficients For Variational Transition State Theory Calculations Of Reaction Rates
Potlib 2001: A Potential Energy Surface Library For Chemical Systems
Experimental And Theoretical Insights Regarding The Cycloaddition Reaction Of Carbohydrate-Based 1,2-Diaza-1,3-Butadienes And Acrylonitrile. A Model Case For The Behavior Of Chiral Azoalkenes And Unsymmetric Olefinst
Potlib 2001: A Potential Energy Surface Library For Chemical Systems
Experimental And Theoretical Insights Regarding The Cycloaddition Reaction Of Carbohydrate-Based 1,2-Diaza-1,3-Butadienes And Acrylonitrile. A Model Case For The Behavior Of Chiral Azoalkenes And Unsymmetric Olefinst
Can We Predict The Conformational Preference Of Amides?
Experimental And Theoretical Insights Regarding The Cycloaddition Reaction Of Carbohydrate-Based 1,2-Diaza-1,3-Butadienes And Acrylonitrile. A Model Case For The Behavior Of Chiral Azoalkenes And Unsymmetric Olefinst
Can We Predict The Conformational Preference Of Amides?
Carbohydrates As Chiral Controllers: Synthesis Of Dihydrothieno[2,3-C]furanones
Can We Predict The Conformational Preference Of Amides?
Carbohydrates As Chiral Controllers: Synthesis Of Dihydrothieno[2,3-C]furanones
A Cycloaddition Strategy For The Synthesis Of Thiirane-Containing Glycomimetics
Carbohydrates As Chiral Controllers: Synthesis Of Dihydrothieno[2,3-C]furanones
A Cycloaddition Strategy For The Synthesis Of Thiirane-Containing Glycomimetics
Synergic Effect Of Vicinal Stereocenters In [3 + 2] Cycloadditions Of Carbohydrate Azadipolarophiles And Mesoionic Dipoles: Origin Of Diastereofacial Selectivity
A Cycloaddition Strategy For The Synthesis Of Thiirane-Containing Glycomimetics
Synergic Effect Of Vicinal Stereocenters In [3 + 2] Cycloadditions Of Carbohydrate Azadipolarophiles And Mesoionic Dipoles: Origin Of Diastereofacial Selectivity
Three- And Four-Membered Rings From Cycloadditions Of 1,3-Thiazolium-4-Olates And Aldehydes
Synergic Effect Of Vicinal Stereocenters In [3 + 2] Cycloadditions Of Carbohydrate Azadipolarophiles And Mesoionic Dipoles: Origin Of Diastereofacial Selectivity
Three- And Four-Membered Rings From Cycloadditions Of 1,3-Thiazolium-4-Olates And Aldehydes
Elementary Asymmetry And Biochirality: No Longer Twinned
Three- And Four-Membered Rings From Cycloadditions Of 1,3-Thiazolium-4-Olates And Aldehydes
Elementary Asymmetry And Biochirality: No Longer Twinned
Conjugate Additions Of Heteronucleophiles To Enones And Alkynoates. A 'benign By Design' Functionalization Of Heteroaromatics
Elementary Asymmetry And Biochirality: No Longer Twinned
Conjugate Additions Of Heteronucleophiles To Enones And Alkynoates. A 'benign By Design' Functionalization Of Heteroaromatics
Synthesis Of Dihydrothiophenes By An Amino-Directed Thioisomünchnone-Alkene Cycloaddition Reaction
Conjugate Additions Of Heteronucleophiles To Enones And Alkynoates. A 'benign By Design' Functionalization Of Heteroaromatics
Synthesis Of Dihydrothiophenes By An Amino-Directed Thioisomünchnone-Alkene Cycloaddition Reaction
Erratum: Synthesis Of Dihydrothiophenes By An Amino-Directed Thioisomünchnone - Alkene Cycloaddition Reaction (European Journal Of Organic Chemistry (2001) (2135-2144))
Synthesis Of Dihydrothiophenes By An Amino-Directed Thioisomünchnone-Alkene Cycloaddition Reaction
Erratum: Synthesis Of Dihydrothiophenes By An Amino-Directed Thioisomünchnone - Alkene Cycloaddition Reaction (European Journal Of Organic Chemistry (2001) (2135-2144))
Canonical Variational Theory For Enzyme Kinetics With The Protein Mean Force And Multidimensional Quantum Mechanical Tunneling Dynamics. Theory And Application To Liver Alcohol Dehydrogenase
Erratum: Synthesis Of Dihydrothiophenes By An Amino-Directed Thioisomünchnone - Alkene Cycloaddition Reaction (European Journal Of Organic Chemistry (2001) (2135-2144))
Canonical Variational Theory For Enzyme Kinetics With The Protein Mean Force And Multidimensional Quantum Mechanical Tunneling Dynamics. Theory And Application To Liver Alcohol Dehydrogenase
Quantum Mechanical Tunneling In Methylamine Dehydrogenase
Canonical Variational Theory For Enzyme Kinetics With The Protein Mean Force And Multidimensional Quantum Mechanical Tunneling Dynamics. Theory And Application To Liver Alcohol Dehydrogenase
Quantum Mechanical Tunneling In Methylamine Dehydrogenase
Test Of Variational Transition State Theory With Multidimensional Tunneling Contributions Against An Accurate Full-Dimensional Rate Constant Calculation For A Six-Atom System
Quantum Mechanical Tunneling In Methylamine Dehydrogenase
Test Of Variational Transition State Theory With Multidimensional Tunneling Contributions Against An Accurate Full-Dimensional Rate Constant Calculation For A Six-Atom System
Molecular Mechanics For Chemical Reactions: A Standard Strategy For Using Multiconfiguration Molecular Mechanics For Variational Transition State Theory With Optimized Multidimensional Tunneling
Test Of Variational Transition State Theory With Multidimensional Tunneling Contributions Against An Accurate Full-Dimensional Rate Constant Calculation For A Six-Atom System
Molecular Mechanics For Chemical Reactions: A Standard Strategy For Using Multiconfiguration Molecular Mechanics For Variational Transition State Theory With Optimized Multidimensional Tunneling
Rail: Reaction-Path And Variational Rate Constants Using The Integrated Molecular Orbital With Harmonic Cap Method
Molecular Mechanics For Chemical Reactions: A Standard Strategy For Using Multiconfiguration Molecular Mechanics For Variational Transition State Theory With Optimized Multidimensional Tunneling
Rail: Reaction-Path And Variational Rate Constants Using The Integrated Molecular Orbital With Harmonic Cap Method
Reactions Of 2-Amino-2-Thiazolines With Isocyanates And Isothiocyanates. Chemical And Computational Studies On The Regioselectivity, Adduct Rearrangement, And Mechanistic Pathways
Rail: Reaction-Path And Variational Rate Constants Using The Integrated Molecular Orbital With Harmonic Cap Method
Reactions Of 2-Amino-2-Thiazolines With Isocyanates And Isothiocyanates. Chemical And Computational Studies On The Regioselectivity, Adduct Rearrangement, And Mechanistic Pathways
The First Density Functional Study On The [4 + 2]-Cycloaddition Reactions Of 1,2-Diaza-1,3-Butadiene With Alkenes
Reactions Of 2-Amino-2-Thiazolines With Isocyanates And Isothiocyanates. Chemical And Computational Studies On The Regioselectivity, Adduct Rearrangement, And Mechanistic Pathways
The First Density Functional Study On The [4 + 2]-Cycloaddition Reactions Of 1,2-Diaza-1,3-Butadiene With Alkenes
Computational Studies On The Bf3-Catalyzed Cycloaddition Of Furan With Methyl Vinyl Ketone: A New Look At Lewis Acid Catalysis
The First Density Functional Study On The [4 + 2]-Cycloaddition Reactions Of 1,2-Diaza-1,3-Butadiene With Alkenes
Computational Studies On The Bf3-Catalyzed Cycloaddition Of Furan With Methyl Vinyl Ketone: A New Look At Lewis Acid Catalysis
Diastereoselective Cycloadditions Of 1,3-Thiazolium-4-Olates With Chiral 1,2-Diaza-1,3-Butadienes
Computational Studies On The Bf3-Catalyzed Cycloaddition Of Furan With Methyl Vinyl Ketone: A New Look At Lewis Acid Catalysis
Diastereoselective Cycloadditions Of 1,3-Thiazolium-4-Olates With Chiral 1,2-Diaza-1,3-Butadienes
From Parity To Chirality: Chemical Implications Revisited
Diastereoselective Cycloadditions Of 1,3-Thiazolium-4-Olates With Chiral 1,2-Diaza-1,3-Butadienes
From Parity To Chirality: Chemical Implications Revisited
Chiral Autocatalysis: Where Stereochemistry Meets The Origin Of Life
From Parity To Chirality: Chemical Implications Revisited
Chiral Autocatalysis: Where Stereochemistry Meets The Origin Of Life
Sonochemical Cycloadditions Of O-Quinones. The Search For A Cation Radical Pathway
Chiral Autocatalysis: Where Stereochemistry Meets The Origin Of Life
Sonochemical Cycloadditions Of O-Quinones. The Search For A Cation Radical Pathway
Optically Active Sugar Thioamides From Δ-Gluconolactone
Sonochemical Cycloadditions Of O-Quinones. The Search For A Cation Radical Pathway
Optically Active Sugar Thioamides From Δ-Gluconolactone
[3+2]-Cycloadditions Of 2-Aminothioisomunchnones To Alkynes: Synthetic Scope And Mechanistic Insights
Optically Active Sugar Thioamides From Δ-Gluconolactone
[3+2]-Cycloadditions Of 2-Aminothioisomunchnones To Alkynes: Synthetic Scope And Mechanistic Insights
Understanding Diastereofacial Selection In Carbohydrate-Based Domino Cycloadditions: Semiempirical And Dft Calculations
[3+2]-Cycloadditions Of 2-Aminothioisomunchnones To Alkynes: Synthetic Scope And Mechanistic Insights
Understanding Diastereofacial Selection In Carbohydrate-Based Domino Cycloadditions: Semiempirical And Dft Calculations
Quantum Dynamics Of Hydride Transfer In Enzyme Catalysis
Understanding Diastereofacial Selection In Carbohydrate-Based Domino Cycloadditions: Semiempirical And Dft Calculations
Quantum Dynamics Of Hydride Transfer In Enzyme Catalysis
Potential Energy Surface For A Seven-Atom Reaction. Thermal Rate Constants And Kinetic Isotope Effects For Ch4+oh
Quantum Dynamics Of Hydride Transfer In Enzyme Catalysis
Potential Energy Surface For A Seven-Atom Reaction. Thermal Rate Constants And Kinetic Isotope Effects For Ch4+oh
Multiconfiguration Molecular Mechanics Algorithm For Potential Energy Surfaces Of Chemical Reactions
Potential Energy Surface For A Seven-Atom Reaction. Thermal Rate Constants And Kinetic Isotope Effects For Ch4+oh
Multiconfiguration Molecular Mechanics Algorithm For Potential Energy Surfaces Of Chemical Reactions
Potential Energy Surface, Thermal, And State-Selected Rate Coefficients, And Kinetic Isotope Effects For Cl+ch4→hcl+ch3
Multiconfiguration Molecular Mechanics Algorithm For Potential Energy Surfaces Of Chemical Reactions
Potential Energy Surface, Thermal, And State-Selected Rate Coefficients, And Kinetic Isotope Effects For Cl+ch4→hcl+ch3
Expeditious Formation Of 1,2,4-Triazine Derivatives Via A Thioisomunchnone Cycloaddition Reaction
Potential Energy Surface, Thermal, And State-Selected Rate Coefficients, And Kinetic Isotope Effects For Cl+ch4→hcl+ch3
Expeditious Formation Of 1,2,4-Triazine Derivatives Via A Thioisomunchnone Cycloaddition Reaction
Atropisomeric Carbohydrate Imidazolidines: A Novel Class Of Nonbiaryl Atropisomers
Expeditious Formation Of 1,2,4-Triazine Derivatives Via A Thioisomunchnone Cycloaddition Reaction
Atropisomeric Carbohydrate Imidazolidines: A Novel Class Of Nonbiaryl Atropisomers
Unexpected Formation Of Β-Lactams And Penem Isosteres From Mesoionics: Sequential Ring-Opening-Rearrangement Of [3 + 2] Cycloadducts
Atropisomeric Carbohydrate Imidazolidines: A Novel Class Of Nonbiaryl Atropisomers
Unexpected Formation Of Β-Lactams And Penem Isosteres From Mesoionics: Sequential Ring-Opening-Rearrangement Of [3 + 2] Cycloadducts
Hetero-Diels-Alder Reactions Of Homochiral 1,2-Diaza-1,3-Butadienes With Diethyl Azodicarboxylate Under Microwave Irradiation. Theoretical Rationale Of The Stereochemical Outcome
Unexpected Formation Of Β-Lactams And Penem Isosteres From Mesoionics: Sequential Ring-Opening-Rearrangement Of [3 + 2] Cycloadducts
Hetero-Diels-Alder Reactions Of Homochiral 1,2-Diaza-1,3-Butadienes With Diethyl Azodicarboxylate Under Microwave Irradiation. Theoretical Rationale Of The Stereochemical Outcome
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 1. Stereoselective Synthesis Of 1-Aryl-5-Hydroxyimidazolidine-2-Thiones And Their Transformation Into Imidazoline-2-Thiones
Hetero-Diels-Alder Reactions Of Homochiral 1,2-Diaza-1,3-Butadienes With Diethyl Azodicarboxylate Under Microwave Irradiation. Theoretical Rationale Of The Stereochemical Outcome
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 1. Stereoselective Synthesis Of 1-Aryl-5-Hydroxyimidazolidine-2-Thiones And Their Transformation Into Imidazoline-2-Thiones
Diastereoselective Cycloadditions Of Nitroalkenes As An Approach To The Assembly Of Bicyclic Nitrogen Heterocycles
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 1. Stereoselective Synthesis Of 1-Aryl-5-Hydroxyimidazolidine-2-Thiones And Their Transformation Into Imidazoline-2-Thiones
Diastereoselective Cycloadditions Of Nitroalkenes As An Approach To The Assembly Of Bicyclic Nitrogen Heterocycles
Synthetic Variations Based On Low-Valent Chromium: New Developments
Diastereoselective Cycloadditions Of Nitroalkenes As An Approach To The Assembly Of Bicyclic Nitrogen Heterocycles
Synthetic Variations Based On Low-Valent Chromium: New Developments
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 2. Atropisomeric Behavior Of Monocyclic And Bicyclic Imidazolidine-2-Ones And 2- Thiones
Synthetic Variations Based On Low-Valent Chromium: New Developments
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 2. Atropisomeric Behavior Of Monocyclic And Bicyclic Imidazolidine-2-Ones And 2- Thiones
Green Chemistry: The Sonochemical Approach
Non-Biaryl Atropisomers Derived From Carbohydrates. Part 2. Atropisomeric Behavior Of Monocyclic And Bicyclic Imidazolidine-2-Ones And 2- Thiones
Green Chemistry: The Sonochemical Approach
Multi-Coefficient Correlation Method For Quantum Chemistry
Green Chemistry: The Sonochemical Approach
Multi-Coefficient Correlation Method For Quantum Chemistry
The Gaussian-2 Method With Proper Dissociation, Improved Accuracy, And Less Cost
Multi-Coefficient Correlation Method For Quantum Chemistry
The Gaussian-2 Method With Proper Dissociation, Improved Accuracy, And Less Cost
Variational Transition-State Theory With Optimized Orientation Of The Dividing Surface And Semiclassical Tunneling Calculations For Deuterium And Muonium Kinetic Isotope Effects In The Free Radical Association Reaction H + C2h4 → C2h5
The Gaussian-2 Method With Proper Dissociation, Improved Accuracy, And Less Cost
Variational Transition-State Theory With Optimized Orientation Of The Dividing Surface And Semiclassical Tunneling Calculations For Deuterium And Muonium Kinetic Isotope Effects In The Free Radical Association Reaction H + C2h4 → C2h5
Quantum Mechanical Dynamical Effects In An Enzyme-Catalyzed Proton Transfer Reaction
Variational Transition-State Theory With Optimized Orientation Of The Dividing Surface And Semiclassical Tunneling Calculations For Deuterium And Muonium Kinetic Isotope Effects In The Free Radical Association Reaction H + C2h4 → C2h5
Quantum Mechanical Dynamical Effects In An Enzyme-Catalyzed Proton Transfer Reaction
Mapped Interpolation Scheme For Single-Point Energy Corrections In Reaction Rate Calculations And A Critical Evaluation Of Dual-Level Reaction Path Dynamics Methods
Quantum Mechanical Dynamical Effects In An Enzyme-Catalyzed Proton Transfer Reaction
Mapped Interpolation Scheme For Single-Point Energy Corrections In Reaction Rate Calculations And A Critical Evaluation Of Dual-Level Reaction Path Dynamics Methods
Thermochemistry, Solvation, And Dynamics
Mapped Interpolation Scheme For Single-Point Energy Corrections In Reaction Rate Calculations And A Critical Evaluation Of Dual-Level Reaction Path Dynamics Methods
Thermochemistry, Solvation, And Dynamics
Clay-Catalyzed Solventless Addition Reactions Of Furan With Α,β- Unsaturated Carbonyl Compounds
Thermochemistry, Solvation, And Dynamics
Clay-Catalyzed Solventless Addition Reactions Of Furan With Α,β- Unsaturated Carbonyl Compounds
Cycloadditions With Clays And Alumina Without Solvents
Clay-Catalyzed Solventless Addition Reactions Of Furan With Α,β- Unsaturated Carbonyl Compounds
Cycloadditions With Clays And Alumina Without Solvents
The Structure Of Glycosyl Amides: A Combined Study By Nmr Spectroscopy, X-Ray Crystallography, And Computational Chemistry
Cycloadditions With Clays And Alumina Without Solvents
The Structure Of Glycosyl Amides: A Combined Study By Nmr Spectroscopy, X-Ray Crystallography, And Computational Chemistry
Absolute Asymmetric Synthesis Under Physical Fields: Facts And Fictions
The Structure Of Glycosyl Amides: A Combined Study By Nmr Spectroscopy, X-Ray Crystallography, And Computational Chemistry
Absolute Asymmetric Synthesis Under Physical Fields: Facts And Fictions
Asymmetric Tandem Reactions Based On Nitroalkenes: A One-Pot Construction Of Functionalized Chiral Bicycles By A Three-Component Reaction
Absolute Asymmetric Synthesis Under Physical Fields: Facts And Fictions
Asymmetric Tandem Reactions Based On Nitroalkenes: A One-Pot Construction Of Functionalized Chiral Bicycles By A Three-Component Reaction
The Calculation Of Kinetic Isotope Effects Based On A Single Reaction Path
Asymmetric Tandem Reactions Based On Nitroalkenes: A One-Pot Construction Of Functionalized Chiral Bicycles By A Three-Component Reaction
The Calculation Of Kinetic Isotope Effects Based On A Single Reaction Path
The Sih4+h→sih3+h2 Reaction: Potential Energy Surface, Rate Constants, And Kinetic Isotope Effects
The Calculation Of Kinetic Isotope Effects Based On A Single Reaction Path
The Sih4+h→sih3+h2 Reaction: Potential Energy Surface, Rate Constants, And Kinetic Isotope Effects
Explanation Of Deuterium And Muonium Kinetic Isotope Effects For Hydrogen Atom Addition To An Olefin [9]
The Sih4+h→sih3+h2 Reaction: Potential Energy Surface, Rate Constants, And Kinetic Isotope Effects
Explanation Of Deuterium And Muonium Kinetic Isotope Effects For Hydrogen Atom Addition To An Olefin [9]
Dual-Level Direct Dynamics Calculations Of The Reaction Rates For A Jahn-Teller Reaction: Hydrogen Abstraction From Ch4 Or Cd4 By O(3p)
Explanation Of Deuterium And Muonium Kinetic Isotope Effects For Hydrogen Atom Addition To An Olefin [9]
Dual-Level Direct Dynamics Calculations Of The Reaction Rates For A Jahn-Teller Reaction: Hydrogen Abstraction From Ch4 Or Cd4 By O(3p)
Interpolated Variational Transition-State Theory By Mapping
Dual-Level Direct Dynamics Calculations Of The Reaction Rates For A Jahn-Teller Reaction: Hydrogen Abstraction From Ch4 Or Cd4 By O(3p)
Interpolated Variational Transition-State Theory By Mapping
Integrated Molecular Orbital Method With Harmonic Cap For Molecular Forces And Its Application To Geometry Optimization And The Calculation Of Vibrational Frequencies
Interpolated Variational Transition-State Theory By Mapping
Integrated Molecular Orbital Method With Harmonic Cap For Molecular Forces And Its Application To Geometry Optimization And The Calculation Of Vibrational Frequencies
Dual-Level Methods For Electronic Structure Calculations Of Potential Energy Functions That Use Quantum Mechanics As The Lower Level
Integrated Molecular Orbital Method With Harmonic Cap For Molecular Forces And Its Application To Geometry Optimization And The Calculation Of Vibrational Frequencies
Dual-Level Methods For Electronic Structure Calculations Of Potential Energy Functions That Use Quantum Mechanics As The Lower Level
Reactions Of Thioamides With Metal Carboxylates In Organic Media
Dual-Level Methods For Electronic Structure Calculations Of Potential Energy Functions That Use Quantum Mechanics As The Lower Level
Reactions Of Thioamides With Metal Carboxylates In Organic Media
Nonlinear Stereochemical Effects In Asymmetric Reactions
Reactions Of Thioamides With Metal Carboxylates In Organic Media
Nonlinear Stereochemical Effects In Asymmetric Reactions
Understanding The Activation Energy Trends For The C2h4+oh→c2h4oh Reaction By Using Canonical Variational Transition State Theory
Nonlinear Stereochemical Effects In Asymmetric Reactions
Understanding The Activation Energy Trends For The C2h4+oh→c2h4oh Reaction By Using Canonical Variational Transition State Theory
Analytical Surface For The Reaction With No Saddle-Point Nh3 + F → Nh2 + Fh. Application Of Variational Transition State Theory
Understanding The Activation Energy Trends For The C2h4+oh→c2h4oh Reaction By Using Canonical Variational Transition State Theory
Analytical Surface For The Reaction With No Saddle-Point Nh3 + F → Nh2 + Fh. Application Of Variational Transition State Theory
Molecular Modeling Of Combustion Kinetics. The Abstraction Of Primary And Secondary Hydrogens By Hydroxyl Radical
Analytical Surface For The Reaction With No Saddle-Point Nh3 + F → Nh2 + Fh. Application Of Variational Transition State Theory
Molecular Modeling Of Combustion Kinetics. The Abstraction Of Primary And Secondary Hydrogens By Hydroxyl Radical
Analytical Potential Energy Surface For The Nh3+h↔nh2+h2 Reaction: Application Of Variational Transition-State Theory And Analysis Of The Equilibrium Constants And Kinetic Isotope Effects Using Curvilinear And Rectilinear Coordinates
Molecular Modeling Of Combustion Kinetics. The Abstraction Of Primary And Secondary Hydrogens By Hydroxyl Radical
Analytical Potential Energy Surface For The Nh3+h↔nh2+h2 Reaction: Application Of Variational Transition-State Theory And Analysis Of The Equilibrium Constants And Kinetic Isotope Effects Using Curvilinear And Rectilinear Coordinates
Importance Of Quantum Effects For C-H Bond Activation Reactions
Analytical Potential Energy Surface For The Nh3+h↔nh2+h2 Reaction: Application Of Variational Transition-State Theory And Analysis Of The Equilibrium Constants And Kinetic Isotope Effects Using Curvilinear And Rectilinear Coordinates
Importance Of Quantum Effects For C-H Bond Activation Reactions
Nmr Studies And Semiempirical Calculations On The Structure Of Glycoamidines
Importance Of Quantum Effects For C-H Bond Activation Reactions
Nmr Studies And Semiempirical Calculations On The Structure Of Glycoamidines
Cycloaddition Chemistry Of 1,3-Thiazolium-4-Olate Systems. Reaction With Nitroalkenes And Interpretation Of Results Using Pm3 Calculations
Nmr Studies And Semiempirical Calculations On The Structure Of Glycoamidines
Cycloaddition Chemistry Of 1,3-Thiazolium-4-Olate Systems. Reaction With Nitroalkenes And Interpretation Of Results Using Pm3 Calculations
Substrate-Controlled Stereodifferentiation Of Tandem [4 + 2]/[3 + 2] Cycloadditions By A Vicinal Carbohydrate-Based Template
Cycloaddition Chemistry Of 1,3-Thiazolium-4-Olate Systems. Reaction With Nitroalkenes And Interpretation Of Results Using Pm3 Calculations
Substrate-Controlled Stereodifferentiation Of Tandem [4 + 2]/[3 + 2] Cycloadditions By A Vicinal Carbohydrate-Based Template
A Simple, Cip-Based Notation System For The Unambiguous Specification Of Asymmetric Reactions
Substrate-Controlled Stereodifferentiation Of Tandem [4 + 2]/[3 + 2] Cycloadditions By A Vicinal Carbohydrate-Based Template
A Simple, Cip-Based Notation System For The Unambiguous Specification Of Asymmetric Reactions
Recalibration Of Two Earlier Potential Energy Surfaces For The Ch4 + H → Ch3 + H2 Reaction. Application Of Variational Transition-State Theory And Analysis Of The Kinetic Isotope Effects Using Rectilinear And Curvilinear Coordinates
A Simple, Cip-Based Notation System For The Unambiguous Specification Of Asymmetric Reactions
Recalibration Of Two Earlier Potential Energy Surfaces For The Ch4 + H → Ch3 + H2 Reaction. Application Of Variational Transition-State Theory And Analysis Of The Kinetic Isotope Effects Using Rectilinear And Curvilinear Coordinates
Theoretical Study Of The Ch4+f→ch3fh Reaction. I. Ab Initio Reaction Path
Recalibration Of Two Earlier Potential Energy Surfaces For The Ch4 + H → Ch3 + H2 Reaction. Application Of Variational Transition-State Theory And Analysis Of The Kinetic Isotope Effects Using Rectilinear And Curvilinear Coordinates
Theoretical Study Of The Ch4+f→ch3fh Reaction. I. Ab Initio Reaction Path
Theoretical Study Of The Ch4+f→ch3+fh Reaction. Ii. Semiempirical Surfaces
Theoretical Study Of The Ch4+f→ch3fh Reaction. I. Ab Initio Reaction Path
Theoretical Study Of The Ch4+f→ch3+fh Reaction. Ii. Semiempirical Surfaces
Analytical Potential Energy Surface For The Ch4+cl→ch3+cih Reaction: Application Of The Variational Transition State Theory And Analysis Of The Kinetic Isotope Effects
Theoretical Study Of The Ch4+f→ch3+fh Reaction. Ii. Semiempirical Surfaces
Analytical Potential Energy Surface For The Ch4+cl→ch3+cih Reaction: Application Of The Variational Transition State Theory And Analysis Of The Kinetic Isotope Effects
Anodic Oxidation Of Thioureido Derivatives Of Biogenic Amines At A Glassy Carbon Electrode In An Aqueous Medium
Analytical Potential Energy Surface For The Ch4+cl→ch3+cih Reaction: Application Of The Variational Transition State Theory And Analysis Of The Kinetic Isotope Effects
Anodic Oxidation Of Thioureido Derivatives Of Biogenic Amines At A Glassy Carbon Electrode In An Aqueous Medium
Münchnone-Alkene Cycloadditions: Deviations From The Fmo Theory. Theoretical Studies In The Search Of The Transition State
Anodic Oxidation Of Thioureido Derivatives Of Biogenic Amines At A Glassy Carbon Electrode In An Aqueous Medium
Münchnone-Alkene Cycloadditions: Deviations From The Fmo Theory. Theoretical Studies In The Search Of The Transition State
Synthesis Of Glycoamidines Using A Mercury-Promoted Reaction
Münchnone-Alkene Cycloadditions: Deviations From The Fmo Theory. Theoretical Studies In The Search Of The Transition State
Synthesis Of Glycoamidines Using A Mercury-Promoted Reaction
A Facile And Expeditious Entry To Acyclic Carbohydrate-Derived 1,2-Diazabutadienes
Synthesis Of Glycoamidines Using A Mercury-Promoted Reaction
A Facile And Expeditious Entry To Acyclic Carbohydrate-Derived 1,2-Diazabutadienes
A Novel Highly Diastereoselective Synthesis Of Chiral Dihydrothiophenes From Mesoionic Compounds
A Facile And Expeditious Entry To Acyclic Carbohydrate-Derived 1,2-Diazabutadienes
A Novel Highly Diastereoselective Synthesis Of Chiral Dihydrothiophenes From Mesoionic Compounds
Synthetic Organoindium Chemistry: What Makes Indium So Appealing?
A Novel Highly Diastereoselective Synthesis Of Chiral Dihydrothiophenes From Mesoionic Compounds
Synthetic Organoindium Chemistry: What Makes Indium So Appealing?
Theoretical Values Of The Enthalpies Of Formation Of The Nhx (X = 1,2,3) Compounds. Importance Of The Core-Correlation Effects
Synthetic Organoindium Chemistry: What Makes Indium So Appealing?
Theoretical Values Of The Enthalpies Of Formation Of The Nhx (X = 1,2,3) Compounds. Importance Of The Core-Correlation Effects
Theoretical Approach To The Thermochemistry And Barrier Heights Of The First Steps Of The Radical And Anionic Polymerization Of Ethene And Formaldehyde
Theoretical Values Of The Enthalpies Of Formation Of The Nhx (X = 1,2,3) Compounds. Importance Of The Core-Correlation Effects
Theoretical Approach To The Thermochemistry And Barrier Heights Of The First Steps Of The Radical And Anionic Polymerization Of Ethene And Formaldehyde
Dual-Level Reaction-Path Dynamics (The Iii Approach To Vtst With Semiclassical Tunneling). Application To Oh + Nh3 → H2o + Nh2
Theoretical Approach To The Thermochemistry And Barrier Heights Of The First Steps Of The Radical And Anionic Polymerization Of Ethene And Formaldehyde
Dual-Level Reaction-Path Dynamics (The Iii Approach To Vtst With Semiclassical Tunneling). Application To Oh + Nh3 → H2o + Nh2
Reliability Of The Single-Point Calculation Technique At Characteristic Points Of The Potential Energy Surface
Dual-Level Reaction-Path Dynamics (The Iii Approach To Vtst With Semiclassical Tunneling). Application To Oh + Nh3 → H2o + Nh2
Reliability Of The Single-Point Calculation Technique At Characteristic Points Of The Potential Energy Surface
Organometallic Catalysis [2]
Reliability Of The Single-Point Calculation Technique At Characteristic Points Of The Potential Energy Surface
Organometallic Catalysis [2]
Transition State Theory And Eckart's Tunnelling Factor: A Good Approximation For The Calculation Of Bimolecular Rate Constants?
Organometallic Catalysis [2]
Transition State Theory And Eckart's Tunnelling Factor: A Good Approximation For The Calculation Of Bimolecular Rate Constants?
Erratum: Theoretical Study Of Intermediate Complexes And The Saddle Point For Nh3 + Oh → Nh2 + H2o (Journal Of Physical Chemistry (1993) 97, (9130))
Transition State Theory And Eckart's Tunnelling Factor: A Good Approximation For The Calculation Of Bimolecular Rate Constants?
Erratum: Theoretical Study Of Intermediate Complexes And The Saddle Point For Nh3 + Oh → Nh2 + H2o (Journal Of Physical Chemistry (1993) 97, (9130))
Theoretical Values Of The Enthalpies Of Formation Of The Sh And Hso Radicals
Erratum: Theoretical Study Of Intermediate Complexes And The Saddle Point For Nh3 + Oh → Nh2 + H2o (Journal Of Physical Chemistry (1993) 97, (9130))
Theoretical Values Of The Enthalpies Of Formation Of The Sh And Hso Radicals
Theoretical Rate Constants: On The Error Cancellation Using Conventional Transition-State Theory And Wigner's Tunnelling Correction
Theoretical Values Of The Enthalpies Of Formation Of The Sh And Hso Radicals
Theoretical Rate Constants: On The Error Cancellation Using Conventional Transition-State Theory And Wigner's Tunnelling Correction
Variational Transition-State Theory Calculation Using The Direct Dynamics Method: Nh3+h→nh2+h2 Reaction
Theoretical Rate Constants: On The Error Cancellation Using Conventional Transition-State Theory And Wigner's Tunnelling Correction
Variational Transition-State Theory Calculation Using The Direct Dynamics Method: Nh3+h→nh2+h2 Reaction
Analysis Of Certain Factors In The Direct Dynamics Method: Variational Rate Constant Of The Nh3+oh→nh2+h2o Reaction
Variational Transition-State Theory Calculation Using The Direct Dynamics Method: Nh3+h→nh2+h2 Reaction
Analysis Of Certain Factors In The Direct Dynamics Method: Variational Rate Constant Of The Nh3+oh→nh2+h2o Reaction
Cucurbituril: Supramolecular Perspectives For An Old Ligand
Analysis Of Certain Factors In The Direct Dynamics Method: Variational Rate Constant Of The Nh3+oh→nh2+h2o Reaction
Cucurbituril: Supramolecular Perspectives For An Old Ligand
Condensation Of 2-Amino-2-Deoxysugars With Isothiocyanates. Synthesis Of Cis-1,2-Fused Glycopyrano Heterocycles.
Cucurbituril: Supramolecular Perspectives For An Old Ligand
Condensation Of 2-Amino-2-Deoxysugars With Isothiocyanates. Synthesis Of Cis-1,2-Fused Glycopyrano Heterocycles.
Ab Initio Evaluation Of The Barrier Height. Theoretical Rate Constant Of The Nh3 + H → Nh2 + H2 Reaction
Condensation Of 2-Amino-2-Deoxysugars With Isothiocyanates. Synthesis Of Cis-1,2-Fused Glycopyrano Heterocycles.
Ab Initio Evaluation Of The Barrier Height. Theoretical Rate Constant Of The Nh3 + H → Nh2 + H2 Reaction
Reaction Of Thioamides With Silver Carboxylates In Aprotic Media. A Nucleophilic Approach To The Synthesis Of Imides, Amides, And Nitriles
Ab Initio Evaluation Of The Barrier Height. Theoretical Rate Constant Of The Nh3 + H → Nh2 + H2 Reaction
Reaction Of Thioamides With Silver Carboxylates In Aprotic Media. A Nucleophilic Approach To The Synthesis Of Imides, Amides, And Nitriles
Theoretical Study Of Intermediate Complexes And The Saddle Point For Nh3 + Oh → Nh2 + H2o
Reaction Of Thioamides With Silver Carboxylates In Aprotic Media. A Nucleophilic Approach To The Synthesis Of Imides, Amides, And Nitriles
Theoretical Study Of Intermediate Complexes And The Saddle Point For Nh3 + Oh → Nh2 + H2o
Misconduct In Science [2]
Theoretical Study Of Intermediate Complexes And The Saddle Point For Nh3 + Oh → Nh2 + H2o
Misconduct In Science [2]
Structure Of Adducts Of 2-Arylaminothiazolines With Isocyanates And Isothiocyanates
Misconduct In Science [2]
Structure Of Adducts Of 2-Arylaminothiazolines With Isocyanates And Isothiocyanates
On The Mechanism Of Formation Of Glycofurano[2,1-D]-Imidazolidin-2-Ones. Reaction Of 2-Amino-2-Deoxyheptopyranoses With Isocyanates.
Structure Of Adducts Of 2-Arylaminothiazolines With Isocyanates And Isothiocyanates
On The Mechanism Of Formation Of Glycofurano[2,1-D]-Imidazolidin-2-Ones. Reaction Of 2-Amino-2-Deoxyheptopyranoses With Isocyanates.
The Reaction Of 2-Amino-2-Deoxyhexopyranoses With Isocyanates. Synthesis Of Ureas And Their Transformation Into Heterocyclic Derivatives.
On The Mechanism Of Formation Of Glycofurano[2,1-D]-Imidazolidin-2-Ones. Reaction Of 2-Amino-2-Deoxyheptopyranoses With Isocyanates.
The Reaction Of 2-Amino-2-Deoxyhexopyranoses With Isocyanates. Synthesis Of Ureas And Their Transformation Into Heterocyclic Derivatives.
A Novel Regio- And Highly Stereoselective Anomeric Deacetylation Of 2-Aminosugar Derivatives
The Reaction Of 2-Amino-2-Deoxyhexopyranoses With Isocyanates. Synthesis Of Ureas And Their Transformation Into Heterocyclic Derivatives.
A Novel Regio- And Highly Stereoselective Anomeric Deacetylation Of 2-Aminosugar Derivatives
Diastereoselective Synthesis Of Chiral Thiiranes By 1,3-Dipolar Cycloaddition Of Imidazo[2,1-B]thiazolium-4-Olate Systems With Aromatic Aldehydes
A Novel Regio- And Highly Stereoselective Anomeric Deacetylation Of 2-Aminosugar Derivatives
Diastereoselective Synthesis Of Chiral Thiiranes By 1,3-Dipolar Cycloaddition Of Imidazo[2,1-B]thiazolium-4-Olate Systems With Aromatic Aldehydes
Haloalkyl Isothiocyanates, Useful And Versatile Reagents In Heterocyclic Chemistry
Diastereoselective Synthesis Of Chiral Thiiranes By 1,3-Dipolar Cycloaddition Of Imidazo[2,1-B]thiazolium-4-Olate Systems With Aromatic Aldehydes
Haloalkyl Isothiocyanates, Useful And Versatile Reagents In Heterocyclic Chemistry
Addition Of Organochromium Compounds To Aldehydes: The Nozaki-Hiyama Reaction
Haloalkyl Isothiocyanates, Useful And Versatile Reagents In Heterocyclic Chemistry
Addition Of Organochromium Compounds To Aldehydes: The Nozaki-Hiyama Reaction
Nmr Studies Of Sugar Amides And Thioamides
Addition Of Organochromium Compounds To Aldehydes: The Nozaki-Hiyama Reaction
Nmr Studies Of Sugar Amides And Thioamides
A New Synthesis Of 6-Oxopyrimidinium-4-Olates. Theoretical Study Of The Regioselective Cycloaddition Of Arylisocyanates With A 1,3-Thiazolium-4-Olate System
Nmr Studies Of Sugar Amides And Thioamides
A New Synthesis Of 6-Oxopyrimidinium-4-Olates. Theoretical Study Of The Regioselective Cycloaddition Of Arylisocyanates With A 1,3-Thiazolium-4-Olate System
Stereochemical Puzzle [2]
A New Synthesis Of 6-Oxopyrimidinium-4-Olates. Theoretical Study Of The Regioselective Cycloaddition Of Arylisocyanates With A 1,3-Thiazolium-4-Olate System
Stereochemical Puzzle [2]
Diastereofacial Selectivity In Diels-Alder Reactions Of Chiral 1,2-Diaza-1,3-Butadienes From Carbohydrates
Stereochemical Puzzle [2]
Diastereofacial Selectivity In Diels-Alder Reactions Of Chiral 1,2-Diaza-1,3-Butadienes From Carbohydrates
Asymmetric Synthesis Of Α-Amino Acids From Carbohydrates As Chiral Templates
Diastereofacial Selectivity In Diels-Alder Reactions Of Chiral 1,2-Diaza-1,3-Butadienes From Carbohydrates
Asymmetric Synthesis Of Α-Amino Acids From Carbohydrates As Chiral Templates
Synthesis And Reactivity Toward Acetylenic Dipolarophiles Of Imidazo[2,1-B]thiazolium-3-Olate Systems
Asymmetric Synthesis Of Α-Amino Acids From Carbohydrates As Chiral Templates
Synthesis And Reactivity Toward Acetylenic Dipolarophiles Of Imidazo[2,1-B]thiazolium-3-Olate Systems
Synthesis Of Sugar N-(2-Thiazolin-2-Yl)thioureas
Synthesis And Reactivity Toward Acetylenic Dipolarophiles Of Imidazo[2,1-B]thiazolium-3-Olate Systems
Synthesis Of Sugar N-(2-Thiazolin-2-Yl)thioureas
Synthesis Of 2-Alkyl(Aryl)amino-(3,4,6-Tri-O-Acetyl-1,2-Dideoxy-Α-D-Glucopyrano)[2,1-D]-2-Oxazolines And Ethyl 2-[3-Alkyl(Aryl)ureido]-2-Deoxy-Β-D-Glucopyranosides From Acetylated 2-[3-Alkyl(Aryl)ureido]-2-Deoxy-D-Glucopyranoses
Synthesis Of Sugar N-(2-Thiazolin-2-Yl)thioureas
Synthesis Of 2-Alkyl(Aryl)amino-(3,4,6-Tri-O-Acetyl-1,2-Dideoxy-Α-D-Glucopyrano)[2,1-D]-2-Oxazolines And Ethyl 2-[3-Alkyl(Aryl)ureido]-2-Deoxy-Β-D-Glucopyranosides From Acetylated 2-[3-Alkyl(Aryl)ureido]-2-Deoxy-D-Glucopyranoses
Synthesis Of Acylated Thioureylenedisaccharides
Synthesis Of 2-Alkyl(Aryl)amino-(3,4,6-Tri-O-Acetyl-1,2-Dideoxy-Α-D-Glucopyrano)[2,1-D]-2-Oxazolines And Ethyl 2-[3-Alkyl(Aryl)ureido]-2-Deoxy-Β-D-Glucopyranosides From Acetylated 2-[3-Alkyl(Aryl)ureido]-2-Deoxy-D-Glucopyranoses
Synthesis Of Acylated Thioureylenedisaccharides
Reaction Of Glycosylisothiocyanates With 2-Chloroethylamine. Synthesis And Structure Of N-Nucleoside Analogues
Synthesis Of Acylated Thioureylenedisaccharides
Reaction Of Glycosylisothiocyanates With 2-Chloroethylamine. Synthesis And Structure Of N-Nucleoside Analogues
Synthesis Of N,n′-Bis(Aryl)-N-(2-Thiazolin-2-Yl)thioureas
Reaction Of Glycosylisothiocyanates With 2-Chloroethylamine. Synthesis And Structure Of N-Nucleoside Analogues
Synthesis Of N,n′-Bis(Aryl)-N-(2-Thiazolin-2-Yl)thioureas
Reduction Of Isothiocyanates To Thioformamides With Tri-N-Butyltin Hydride
Synthesis Of N,n′-Bis(Aryl)-N-(2-Thiazolin-2-Yl)thioureas
Reduction Of Isothiocyanates To Thioformamides With Tri-N-Butyltin Hydride
An Efficient And Regioselective Synthesis Of Acyclic C-Nucleosides From Mesoionic Compounds
Reduction Of Isothiocyanates To Thioformamides With Tri-N-Butyltin Hydride
An Efficient And Regioselective Synthesis Of Acyclic C-Nucleosides From Mesoionic Compounds
Reaction Of Glycosylisothiocyanates With 2-Chloroethylamine
An Efficient And Regioselective Synthesis Of Acyclic C-Nucleosides From Mesoionic Compounds
Reaction Of Glycosylisothiocyanates With 2-Chloroethylamine
Oxidation Of Enamines Derived From Sugars
Reaction Of Glycosylisothiocyanates With 2-Chloroethylamine
Oxidation Of Enamines Derived From Sugars
Syntheses Of Partially Protected D-Galactopyranosylthioureas: New D-Galactopyranosylimidazoline-2-Thiones And D-Galactopyranosylaminothiazoles
Oxidation Of Enamines Derived From Sugars
Syntheses Of Partially Protected D-Galactopyranosylthioureas: New D-Galactopyranosylimidazoline-2-Thiones And D-Galactopyranosylaminothiazoles
Regioselective Benzoylations Of Glycopyranosylamines: Synthesis Of Partially Protected Glycopyranosyl Isothiocyanates
Syntheses Of Partially Protected D-Galactopyranosylthioureas: New D-Galactopyranosylimidazoline-2-Thiones And D-Galactopyranosylaminothiazoles
Regioselective Benzoylations Of Glycopyranosylamines: Synthesis Of Partially Protected Glycopyranosyl Isothiocyanates
Syntheses Of D-Ribosylamines, D-Ribopyranosyl Isothiocyanates, And D-Ribopyranosylthioureas, And Their Transformations Into Heterocyclic Compounds
Regioselective Benzoylations Of Glycopyranosylamines: Synthesis Of Partially Protected Glycopyranosyl Isothiocyanates
Syntheses Of D-Ribosylamines, D-Ribopyranosyl Isothiocyanates, And D-Ribopyranosylthioureas, And Their Transformations Into Heterocyclic Compounds
Síntesis De Hidrobromuros De Glucopirano [2,1-D]-2-Tiazolinas
Syntheses Of D-Ribosylamines, D-Ribopyranosyl Isothiocyanates, And D-Ribopyranosylthioureas, And Their Transformations Into Heterocyclic Compounds
Síntesis De Hidrobromuros De Glucopirano [2,1-D]-2-Tiazolinas
A New Method For The Preparation Of Acylated Glycosylamines And Their Transformations Into Glycosyl Isothiocyanates And N,n′-Diglycosylthioureas
Síntesis De Hidrobromuros De Glucopirano [2,1-D]-2-Tiazolinas
A New Method For The Preparation Of Acylated Glycosylamines And Their Transformations Into Glycosyl Isothiocyanates And N,n′-Diglycosylthioureas
Preparación Del Hidrocloruro De 2-Amino-2-Desoxi-D-Glicero-D-Altro-Heptosa A Partir De D-Alosa
A New Method For The Preparation Of Acylated Glycosylamines And Their Transformations Into Glycosyl Isothiocyanates And N,n′-Diglycosylthioureas
Preparación Del Hidrocloruro De 2-Amino-2-Desoxi-D-Glicero-D-Altro-Heptosa A Partir De D-Alosa
Synthesis Of D-Ribo-C-Nucleoside Analogues By Dehydration Of New D-Allo-Pentitol-1-Yl Heterocycles
Preparación Del Hidrocloruro De 2-Amino-2-Desoxi-D-Glicero-D-Altro-Heptosa A Partir De D-Alosa
Synthesis Of D-Ribo-C-Nucleoside Analogues By Dehydration Of New D-Allo-Pentitol-1-Yl Heterocycles
Catalytic Screening For 1,2-Diol Protection: A Saccharose-Derived Hydrothermal Carbon Showcases Enhanced Performance
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