Divalent N(I) character in 2-(thiazol-2-yl)guanidine: An electronic structure analysis

Journal of Physical Chemistry A

Volumn 116, Issue 36, 2012, Pages 9071-9079

  Bhatia, Sonam ^a   Bagul, Chandrakant ^a   Kasetti, Yoganjaneyulu ^a   Patel, Dhilon S ^a   Bharatam, Prasad V ^a  

^a NATIONAL INSTITUTE OF PHARMACEUTICAL EDUCATION AND RESEARCH NIPER   (India)

Author keywords

[No Author keywords available]

Indexed keywords

AS SPECIES; ELECTRON DELOCALIZATION; MODEL SYSTEM; NBO ANALYSIS; OXIDATION STATE; PROTONATION ENERGY; QUANTUM CHEMICAL STUDIES;

CHEMICAL COMPOUNDS; PROTONATION; QUANTUM CHEMISTRY; QUANTUM THEORY;

ELECTRONIC STRUCTURE;

2 (THIAZOL 2 YL)GUANIDINE; 2-(THIAZOL-2-YL)GUANIDINE; GUANIDINE DERIVATIVE; NITROGEN; THIAZOLE DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; ELECTRON;

COMPUTER SIMULATION; ELECTRONS; GUANIDINES; MODELS, MOLECULAR; NITROGEN; THIAZOLES;

EID: 84866335460     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp304789u     Document Type: Article

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