Vibrational spectrum and assignments of 2-(4-methoxyphenyl)-1H-benzo[d]imidazole by ab initio Hartree-Fock and density functional methods

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 70, Issue 1, 2008, Pages 109-116

  Arslan, Hakan ^a   Algül, Öztekin ^a  

^a MERSIN UNIVERSITY   (Turkey)

Author keywords

Ab initio; Benzimidazole; DFT; FT IR ATR spectrum; HF

Indexed keywords

CONFORMATIONS; DENSITY FUNCTIONAL THEORY; FOURIER TRANSFORM INFRARED SPECTROSCOPY; VIBRATIONAL SPECTRA;

AB INITIO HARTREE-FOCK METHOD; BENZIMIDAZOLE; FT-IR ATR SPECTRUM; ROOM TEMPERATURE;

BENZENE;

BENZIMIDAZOLE DERIVATIVE;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; CONFORMATION; INFRARED SPECTROSCOPY; INSTRUMENTATION; METHODOLOGY; SYNTHESIS; VIBRATION;

BENZIMIDAZOLES; MODELS, CHEMICAL; MOLECULAR CONFORMATION; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; VIBRATION;

EID: 42949105174     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2007.07.027     Document Type: Article

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