pH-dependent Raman study of pyrrole and its vibrational analysis using DFT calculations

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 71, Issue 3, 2008, Pages 823-829

  Singh, Dheeraj K ^a   Srivastava, Sunil K ^b   Ojha, Animesh K ^c   Asthana, B P ^a  

^a BANARAS HINDU UNIVERSITY   (India)

^b UNIVERSITY OF WÜRZBURG   (Germany)

^c MOTILAL NEHRU NATIONAL INSTITUTE OF TECHNOLOGY   (India)

Author keywords

DFT calculations; PCM model; PED; pH dependent Raman study; Pyrrole; Vibrational spectra

Indexed keywords

SULFUR COMPOUNDS;

DFT CALCULATIONS; PCM MODEL; PED; PH-DEPENDENT RAMAN STUDY; PYRROLE; VIBRATIONAL SPECTRA;

NITROGEN COMPOUNDS;

PROTON; PYRROLE DERIVATIVE; WATER;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; PH; RAMAN SPECTROMETRY; SOLUTION AND SOLUBILITY; THERMODYNAMICS;

HYDROGEN-ION CONCENTRATION; MODELS, CHEMICAL; PROTONS; PYRROLES; SOLUTIONS; SPECTRUM ANALYSIS, RAMAN; THERMODYNAMICS; WATER;

EID: 53849143268     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2008.02.032     Document Type: Article

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