The catalytic potential of substituted pyridines in acylation reactions: Theoretical prediction and experimental validation

ChemCatChem

Volumn 4, Issue 4, 2012, Pages 559-566

  Larionov, Evgeny ^a   Achrainer, Florian ^a   Humin, Jowita ^a   Zipse, Hendrik ^a  

^a UNIVERSITY OF MUNICH   (Germany)

Author keywords

Acylation; Density functional calculations; Organocatalysis; Structure activity relationships; Transition states

Indexed keywords

ACYLATION REACTIONS; CATALYTIC CYCLES; CATALYTIC POTENTIAL; DENSITY-FUNCTIONAL CALCULATIONS; EXPERIMENTAL VALIDATIONS; ORGANOCATALYSIS; RATE-LIMITING STEPS; STRUCTURE ACTIVITY RELATIONSHIPS; TERTIARY ALCOHOLS; THEORETICAL PREDICTION; TRANSITION STATE;

ACETYLATION; ACYLATION; DENSITY FUNCTIONAL THEORY; QUANTUM CHEMISTRY; REACTION KINETICS;

CATALYSTS;

EID: 84859115791     PISSN: 18673880     EISSN: 18673899     Source Type: Journal    
DOI: 10.1002/cctc.201100313     Document Type: Article

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