Molecular geometry as a source of chemical information. 5. Substituent effect on proton transfer in para-substituted phenol complexes with fluoride-a B3LYP/6-311+G*G* study

Journal of Chemical Information and Modeling

Volumn 45, Issue 3, 2005, Pages 652-656

  Krygowski, Tadeusz M ^a   Szatylowicz, Halina ^b   Zachara, Joanna E ^a  

^a UNIVERSITY OF WARSAW   (Poland)

^b WARSAW UNIVERSITY OF TECHNOLOGY   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEXATION; FLUORINE COMPOUNDS; HYDROGEN BONDS; MOLECULAR STRUCTURE; PHENOLS; PROTONS;

HAMMETT EQUATION; MOLECULAR GEOMETRY; PROTON TRANSFER; SUBSTITUENTS;

SUBSTITUTION REACTIONS;

EID: 20444417793     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/ci049633d     Document Type: Article

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