Investigation of the structure of and the properties of the potentially tautomeric 1,2,3,4-tetrahydro-5,7-dimethyl-6H-pyrrolo[3,4-d]pyridazine-1,4-diones in the gaseous and aqueous phases using the AM1 semi-empirical method

Journal of Molecular Structure: THEOCHEM

Volumn 434, Issue 1-3, 1998, Pages 7-28

  Güven, Alâattin ^a   Öǧretir, Cemil ^b  

^a ANADOLU UNIVERSITY   (Turkey)

^b ESKISEHIR OSMANGAZI UNIVERSITY   (Turkey)

Author keywords

Acidity; AM1 semi empirical calculation; Basicity; Conformation; Proton affinity; Pyrrolopyridazinones; Tautomeric equilibrium

Indexed keywords

EID: 0345589705     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(98)00072-4     Document Type: Article

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