On tautomeric equilibria in the guanazole molecule. A DFT study

Journal of Molecular Structure: THEOCHEM

Volumn 853, Issue 1-3, 2008, Pages 7-17

  Karpińska, Grazyna ^a   Dobrowolski, Jan Cz ^a,b  

^a NATIONAL MEDICINES INSTITUTE   (Poland)

^b INDUSTRIAL CHEMISTRY RESEARCH INSTITUTE   (Poland)

Author keywords

DFT; Gas phase; Guanazole; IEF PCM; Tautomers; Water

Indexed keywords

EID: 40149099130     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2007.11.036     Document Type: Article

References (22)

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