Experimental (FT-IR, FT-Raman) and theoretical (HF and DFT) investigation and HOMO and LUMO analysis on the structure of p-fluoronitrobenzene

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 83, Issue 1, 2011, Pages 575-586

  Udayakumar, V ^a   Periandy, S ^b   Karabacak, M ^c   Ramalingam, S ^d  

^a Thiru A Govindaswamy Arts College   (India)

^b Tagore Arts College   (India)

^c AFYON KOCATEPE UNIVERSITY   (Turkey)

^d A V C COLLEGE AUTONOMOUS   (India)

Author keywords

FT IR and FT Raman; Fundamental vibrational frequencies; HF and DFT electronic spectra; HOMO LUMO; p Fluronitrobenzene

Indexed keywords

FT-RAMAN; FUNDAMENTAL VIBRATIONAL FREQUENCIES; HF AND DFT ELECTRONIC SPECTRA; HOMO-LUMO; P-FLURONITROBENZENE;

ABSORPTION; CHARGE TRANSFER; ELECTRONIC STRUCTURE; ION EXCHANGE; MOLECULAR ORBITALS; QUANTUM THEORY; RAMAN SPECTROSCOPY; STANDARDS; THERMODYNAMIC PROPERTIES;

ELECTRONIC PROPERTIES;

1 FLUORO 2 NITROBENZENE; 1-FLUORO-2-NITROBENZENE; NITROBENZENE DERIVATIVE;

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

ENTROPY; MODELS, MOLECULAR; NITROBENZENES; QUANTUM THEORY; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; SPECTRUM ANALYSIS, RAMAN;

EID: 80054018294     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2011.09.008     Document Type: Article

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