An ab initio study on the protonation of formaldoxime in its ground and low-lying valence excited states. A model study for the early steps of acid-catalysed photochemical reactions

Journal of Molecular Structure: THEOCHEM

Volumn 360, Issue 1-3, 1996, Pages 1-39

  Marcoccia, John Frank ^a   Yates, Keith ^a   Csizmadia, Imre G ^a  

^a UNIVERSITY OF TORONTO   (Canada)

Author keywords

Ab initio RHF and ROHF calculations on the low lying states of formaldoxime; Excited state basicity; Proton affinity of ground and excited states

Indexed keywords

EID: 18844397412     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/0166-1280(95)04377-2     Document Type: Article

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