Efficient π electrons delocalization in prospective push-pull non-linear optical chromophore 4-[N,N-dimethylamino]-4′-nitro stilbene (DANS): A vibrational spectroscopic study

Chemical Physics

Volumn 343, Issue 1, 2008, Pages 83-99

  Vijayakumar, T ^a   Hubert Joe, I ^a   Reghunadhan Nair, C P ^b   Jayakumar, V S ^a  

^a MAR IVANIOS COLLEGE   (India)

^b INDIAN SPACE RESEARCH ORGANISATION   (India)

Author keywords

Density functional theory; Frontier orbitals; FT IR; HOMO LUMO energy gap; Intramolecular charge transfer (ICT); NIR FT Raman; Non linear optics; Planar conformations; Second harmonic generation

Indexed keywords

EID: 37849004585     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2007.10.033     Document Type: Article

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