A computational study of the Diels-Alder reaction of ethyl-S-lactyl acrylate and cyclopentadiene. Origins of stereoselectivity

Journal of Organic Chemistry

Volumn 69, Issue 24, 2004, Pages 8475-8481

  Bakalova, Snezhana M ^a,b   Santos, A Gil ^a  

^a UNIVERSIDADE NOVA DE LISBOA   (Portugal)

^b INSTITUTE OF ORGANIC CHEMISTRY   (Bulgaria)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; HYDROGEN BONDS; ISOMERS; ORGANIC COMPOUNDS; PROBABILITY DENSITY FUNCTION;

DIELS-ALDER REACTION; REACTION SELECTIVITY; STEREOSELECTIVITY; TRANSITION STRUCTURES;

RATE CONSTANTS;

ACRYLIC ACID; ALKADIENE; CYCLOPENTADIENE DERIVATIVE;

AB INITIO CALCULATION; ARTICLE; CALCULATION; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; DIELS ALDER REACTION; ELECTRICITY; GAS; HYDROGEN BOND; PHASE TRANSITION; REACTION OPTIMIZATION; STEREOCHEMISTRY;

EID: 9344258619     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo049298s     Document Type: Article

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