| Literature DB >> 23896296 |
Leonardo Viana de Freitas1, Cecilia C P da Silva, Javier Ellena, Luiz Antônio Sodré Costa, Nicolás A Rey.
Abstract
A comprehensive structural and vibrational study of the potential metal-protein attenuating compound 8-hydroxyquinoline-2-carboxaldehyde isonicotinoyl hydrazone is reported. X-ray diffraction data, as well as FT-IR and Raman frequencies, were compared with the respective theoretical values obtained from DFT calculations. Theory agrees well with experiment. In this context, an attempt of total assignment concerning the FT-IR and Raman spectra of the title compound was performed, shedding new light on previous partial assignments published elsewhere.Entities:
Keywords: Alzheimer’s disease; DFT calculations; Isoniazid; Vibrational spectroscopy; XRD
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Year: 2013 PMID: 23896296 DOI: 10.1016/j.saa.2013.06.105
Source DB: PubMed Journal: Spectrochim Acta A Mol Biomol Spectrosc ISSN: 1386-1425 Impact factor: 4.098