Theoretical studies of structural effects on the mechanism of Acyl-transfer reactions

Journal of Physical Chemistry A

Volumn 101, Issue 5, 1997, Pages 879-885

  Lee, Ikchoon ^a   Lee, Doyoung ^a   Kim, Chang Kon ^a  

^a Inha University   (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; CALCULATIONS; CHEMICAL BONDS; CORRELATION THEORY; ENERGY GAP; MATHEMATICAL MODELS; SURFACES;

ACYL TRANSFER REACTION; HARTREE-FOCK MODEL; MOLLER-PLESSET MODEL; NUCLEOPHILIC CARBONYL; POTENTIAL ENERGY; STRUCTURAL EFFECTS; TETRAHEDRAL TRANSITION STATE;

ACYLATION;

EID: 0030787257     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp961145o     Document Type: Article

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