Intramolecular interactions along the reaction path of keto-enol tautomerism: Fukui functions as local softnesses and charges as local hardnesses

Journal of Molecular Structure: THEOCHEM

Volumn 686, Issue 1-3, 2004, Pages 213-218

  Hocquet, Alexandre ^a   Toro Labbé, Alejandro ^b   Chermette, Henry ^c  

^a LAB DE CHIM PHYS MACROMOLECULAIRE   (France)

^b PONTIFICIA UNIVERSIDAD CATÓLICA DE CHILE   (Chile)

^c Laboratoire de Chimie Organique   (France)

Author keywords

Fukui function; HSAB; Local hardness; Local softness; Proton transfer; Reaction path; Tautomerism

Indexed keywords

KETO ENOL; KETONE DERIVATIVE; UNCLASSIFIED DRUG;

ARTICLE; ATOM; CHEMICAL REACTION; HARDNESS; MOLECULAR INTERACTION;

EID: 7044224946     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.08.011     Document Type: Article

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