Investigation of the structure and properties of the potentially tautomeric 5,7-dimethyl-6H-pyrrolo[3,4-d]pyridazines in the gas and aqueous phases using the AM1 and PM3/COSMO solvation method

Journal of Molecular Structure: THEOCHEM

Volumn 430, Issue 1-3, 1998, Pages 85-95

  Güven, Alâattin ^a   Öǧretir, Cemil ^b  

^a ANADOLU UNIVERSITY   (Turkey)

^b ESKISEHIR OSMANGAZI UNIVERSITY   (Turkey)

Author keywords

Acidity; Basicity; Proton affinity; Pyrrolopyridazine; Semiempirical calculations; Tautomeric equilibrium

Indexed keywords

EID: 0002991464     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(98)90221-4     Document Type: Article

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