Experimental and theoretical study of the compound [Pd(dmba)(NCO)(imz)]

Journal of Molecular Structure

Volumn 829, Issue 1-3, 2007, Pages 195-201

  Treu Filho, Oswaldo ^a   Pinheiro, José C ^b   da Costa, Edson B ^b   Ferreira, João E V ^b   de Figueiredo, Antonio F ^b   Kondo, Rogério T ^c   de Lucca Neto, Vicente A ^a   de Souza, Rodrigo A ^a   Legendre, Alexandre O ^a   Mauro, Antonio 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

DFT; GCHF method; Infrared spectroscopy; Palladium; Total atomic charges

Indexed keywords

COMPUTATIONAL GEOMETRY; INFRARED RADIATION; ISOMERS; MOLECULAR STRUCTURE; NUCLEAR MAGNETIC RESONANCE; POLARIZATION;

DIFFUSE FUNCTIONS; GCHF METHODS; TOTAL ATOMIC CHARGES; VIBRATIONAL STRUCTURES;

PALLADIUM COMPOUNDS;

EID: 33846811380     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2006.06.018     Document Type: Article

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