Vibrational analyses of 1,3-dibenzoyl-4,5-dihydro-1H-imidazole-2-thione and 1,3-dibenzoyl tetrahydropyrimidine-2(1H)-thione by normal coordinate treatment

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 98, Issue , 2012, Pages 384-395

  Gumus, Sedat ^a   Sundius, Tom ^b   Yilmaz, Veysel Turan ^c  

^a ONDOKUZ MAYIS UNIVERSITY   (Turkey)

^b UNIVERSITY OF HELSINKI   (Finland)

^c ULUDAG UNIVERSITY   (Turkey)

Author keywords

Atomic charge; Imidazole; NBO analysis; Normal coordinate analysis; Thione; Vibrational analysis

Indexed keywords

ATOMIC CHARGE; IMIDAZOLE; NBO ANALYSIS; NORMAL COORDINATE ANALYSIS; THIONE; VIBRATIONAL ANALYSIS;

ATOMS; CHEMICAL BONDS; DENSITY FUNCTIONAL THEORY; MOLECULAR VIBRATIONS;

IODINE;

IMIDAZOLE DERIVATIVE; PYRIMIDINE DERIVATIVE; THIOKETONE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; INFRARED SPECTROSCOPY; QUANTUM THEORY;

IMIDAZOLES; MODELS, MOLECULAR; PYRIMIDINES; QUANTUM THEORY; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; THIONES;

EID: 84867397622     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2012.08.058     Document Type: Article

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