Theoretical and experimental study of the infrared spectrum of isonicotinamide

Journal of Molecular Structure: THEOCHEM

Volumn 763, Issue 1-3, 2006, Pages 175-179

  Filho, O Treu ^a   Pinheiro, J C ^b   Costa, E B da ^b   Kondo, R T ^c   Souza, R A de ^a   Nogueira, V M ^a   Mauro, A E ^a  

^a SÃO PAULO STATE UNIVERSITY UNESP   (Brazil)

^b Instituto de Ciencias Exatas e Naturais   (Brazil)

^c UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

B3LYP level; Basis sets; HFR method; Infrared spectrum; Isonicotinamide

Indexed keywords

EID: 33646492615     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2005.08.046     Document Type: Article

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