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Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, ISSN 1386-1425, 2012, Volume 86, pp. 205 - 213
[Display omitted] ► HOMO and LUMO energy gap explains the eventual charge transfer within the molecule. ► The thermodynamic non-linear optical, first-order... 
HOMO | LUMO | FT-IR | DFT | FT-Raman | 4-Chloro-2-(trifluoromethyl) aniline | FT-RAMAN SPECTRA | MOLECULAR-STRUCTURE | FORCE-FIELDS | NONLINEAR-OPTICAL CHROMOPHORE | HARTREE-FOCK | THEORETICAL AB-INITIO | SPECTROSCOPY | ASSIGNMENT | DENSITY-FUNCTIONAL THEORY | NORMAL-COORDINATE ANALYSIS | Aniline
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