Experimental, theoretical calculations of the vibrational spectra and conformational analysis of 2,4-di-tert-butylphenol

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 85, Issue 1, 2012, Pages 198-209

  Kalaichelvan, S ^a   Sundaraganesan, N ^b   Dereli, O ^c   Sayin, U ^c  

^a AA Govt Arts College   (India)

^b ANNAMALAI UNIVERSITY   (India)

^c SELCUK UNIVERSITY   (Turkey)

Author keywords

2,4 di tert butylphenol; Conformational stability; FT IR; FT Raman; HOMO LUMO; Vibrational spectra

Indexed keywords

2,4-DI-TERT-BUTYLPHENOL; CONFORMATIONAL STABILITIES; FT-IR; FT-RAMAN; HOMO-LUMO;

CHARGE TRANSFER; CONFORMATIONS; MOLECULAR ORBITALS; MOLECULAR STRUCTURE; RAMAN SCATTERING; VIBRATIONAL SPECTRA;

DENSITY FUNCTIONAL THEORY;

2,4 DI(TERT BUTYL)PHENOL; 2,4-DI-TERT-BUTYLPHENOL; ANTIOXIDANT; PHENOL DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; INFRARED SPECTROSCOPY; QUANTUM THEORY; RAMAN SPECTROMETRY;

ANTIOXIDANTS; MODELS, MOLECULAR; MOLECULAR CONFORMATION; PHENOLS; QUANTUM THEORY; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SPECTRUM ANALYSIS, RAMAN;

EID: 81155137803     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2011.09.061     Document Type: Article

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