An ab initio study on protonation of some substituted thiazole derivatives

Journal of Molecular Structure: THEOCHEM

Volumn 715, Issue 1-3, 2005, Pages 199-203

  Yarligan, S ^a   Ogretir, C ^a   Csizmadia, I G ^b,c   Acikkalp, E ^a   Berber, H ^d   Arslan, T ^a  

^a ESKISEHIR OSMANGAZI UNIVERSITY   (Turkey)

^b UNIVERSITY OF TORONTO   (Canada)

^c UNIVERSITY OF SZEGED   (Hungary)

^d ANADOLU UNIVERSITY   (Turkey)

Author keywords

Ab initio calculation; Aza protonation; Oxo protonation; Proto tautomerism; Ring chain tautomerism; Substituent constants

Indexed keywords

THIAZOLE DERIVATIVE;

AB INITIO CALCULATION; ACIDITY; ARTICLE; CORRELATION ANALYSIS; GEOMETRY; MATHEMATICAL ANALYSIS; PROTON TRANSPORT;

EID: 13944252174     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.10.044     Document Type: Article

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