Thorpe-ingold acceleration of oxirane formation is mostly a solvent effect

Journal of the American Chemical Society

Volumn 132, Issue 25, 2010, Pages 8766-8773

  Kostal, Jakub ^a   Jorgensen, William L ^a  

^a YALE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; AQUEOUS SOLUTIONS; CYCLIZATION REACTIONS; GASPHASE; GEM-DIMETHYL; INTRINSIC DIFFERENCES; NUCLEOPHILIC OXYGEN; OXIRANES; RATE INCREASE; SOLVENT EFFECTS; STERIC HINDRANCES;

ALKYLATION; CYCLIZATION; HYDRATION; OXYGEN; STATISTICAL MECHANICS;

METHYLATION;

2 CHLOROETHOXIDE DERIVATIVE; ETHYLENE OXIDE; OXIDE; UNCLASSIFIED DRUG; CHLOROHYDRIN DERIVATIVE; SOLVENT;

AQUEOUS SOLUTION; ARTICLE; COMPUTER SIMULATION; CYCLIZATION; GAS ANALYSIS; HYDRATION; METHYLATION; NUCLEOPHILICITY; OXYGEN AFFINITY; SOLVENT EFFECT; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; KINETICS; MONTE CARLO METHOD; PH; QUANTUM THEORY; THERMODYNAMICS;

CHLOROHYDRINS; CYCLIZATION; ETHYLENE OXIDE; HYDROGEN-ION CONCENTRATION; KINETICS; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MONTE CARLO METHOD; QUANTUM THEORY; SOLVENTS; THERMODYNAMICS;

EID: 77953876449     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja1023755     Document Type: Article

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