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Fourier transform infrared and Raman spectra of the complex cation diethyldithiocarbamate Cr(III) Di-hydrate, [Cr(DDTC)2(OH2)2]+. UV-Vis spectrum, DFT:B3LYP/6-311G(d, p) structural determination, vibrational and natural bond orbital analysis

Eliene Andrade Soares, Claudio Andrés Téllez Zepeda, Sabrina A. Fortes, Anilton Coelho, O. Versiane, Gláucio B. Ferreira, M.A. Mondragón, Claudio A. TéllezS

2022Journal of Molecular Structure19 citationsDOI

Topics & Concepts

ChemistryRaman spectroscopyHydrateAtomic orbitalNatural bond orbitalMolecular orbitalMulliken population analysisCrystallographyInfraredSpectral lineDensity functional theoryPhysical chemistryAnalytical Chemistry (journal)Computational chemistryMoleculeOrganic chemistryPhysicsOpticsElectronChromatographyQuantum mechanicsAstronomyOrganometallic Compounds Synthesis and CharacterizationNonlinear Optical Materials ResearchCrystal structures of chemical compounds
Fourier transform infrared and Raman spectra of the complex cation diethyldithiocarbamate Cr(III) Di-hydrate, [Cr(DDTC)2(OH2)2]+. UV-Vis spectrum, DFT:B3LYP/6-311G(d, p) structural determination, vibrational and natural bond orbital analysis | Litcius