FT-IR, FT-Raman and UV-vis spectra and quantum chemical investigation of carvedilol

Molecular Simulation

Volumn 36, Issue 4, 2010, Pages 283-290

  Jagannathan, Lakshmi ^a   Meenakshi, R ^a   Gunasekaran, S ^b   Srinivasan, S ^c  

^a CTTE College for Women   (India)

^b PACHAIYAPPA S COLLEGE   (India)

^c LN Government College   (India)

Author keywords

Carvedilol; FT IR; FT Raman; NMR chemical shift; UV spectra

Indexed keywords

CALCULATION PROCEDURE; CARVEDILOL; CHEMICAL SELECTIVITY; DENSITY FUNCTIONAL THEORY CALCULATIONS; ELECTRON DENSITIES; ELECTRONIC ABSORPTION SPECTRA; ELECTRONIC TRANSITION ENERGIES; FT-RAMAN; FTIR AND FT-RAMAN SPECTRA; FUKUI FUNCTIONS; INFRARED SPECTRUM; LOCAL REACTIVITY DESCRIPTORS; NMR CHEMICAL SHIFTS; ORBITALS; OSCILLATOR STRENGTHS; QUANTUM CHEMICAL INVESTIGATION; SEMI-EMPIRICAL MOLECULAR ORBITAL METHOD; UV SPECTRUM; UV-VIS SPECTRA;

ABSORPTION SPECTROSCOPY; CHEMICAL SHIFT; DENSITY FUNCTIONAL THEORY; MOLECULAR ORBITALS; NUCLEAR MAGNETIC RESONANCE; OSCILLATORS (ELECTRONIC); PROBABILITY DENSITY FUNCTION; RAMAN SPECTROSCOPY; ULTRAVIOLET SPECTROSCOPY;

INFRARED SPECTROSCOPY;

EID: 77949465544     PISSN: 08927022     EISSN: 10290435     Source Type: Journal    
DOI: 10.1080/08927020903313998     Document Type: Article

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