Experimental and DFT study on the compounds [PdCl2L2] (L =4-methylpyrazole, 4-iodopyrazole)

Experimental and DFT study on the compounds [PdCl2L2] (L =4-methylpyrazole, 4-iodopyrazole)

Theoretical molecular structures of the complexes [PdCl2(HmPz)2] (1) and [PdCl2(HIPz)2] (2) (HmPz = 4-methylpyrazole; HIPz = 4-iodopyrazole) were studied using B3LYP/DFT method. The new complex (2) and the complex (1) were synthesized and characterized by elemental analysis and IR spectroscopy. The...

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Bibliographic Details
Main Authors:	Carolina V Barra, Oswaldo Treu Filho, Fillipe Vieira Rocha, Thales R Moura, Adelino V Godoy Netto, Antonio E Mauro, José C Pinheiro, Rogério T Kondo
Format:	Article
Language:	English
Published:	Slovenian Chemical Society 2015-04-01
Series:	Acta Chimica Slovenica
Subjects:	DFT calculation Infrared Spectroscopy Palladium(II) complexes Pyrazoles
Online Access:	https://journals.matheo.si/index.php/ACSi/article/view/1299

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