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Arivazhagan, M., Manivel, S., Jeyavijayan, S., Meenakshi, R. (2015) Vibrational spectroscopic (FTIR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charge analyses of 2-ethylimidazole based on Hartree–Fock and DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 134. 493-501 doi:10.1016/j.saa.2014.06.108

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Reference TypeJournal (article/letter/editorial)
TitleVibrational spectroscopic (FTIR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charge analyses of 2-ethylimidazole based on Hartree–Fock and DFT calculations
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsArivazhagan, M.Author
Manivel, S.Author
Jeyavijayan, S.Author
Meenakshi, R.Author
Year2015 (January)Volume134
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2014.06.108Search in ResearchGate
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Mindat Ref. ID16395963Long-form Identifiermindat:1:5:16395963:8
GUID0
Full ReferenceArivazhagan, M., Manivel, S., Jeyavijayan, S., Meenakshi, R. (2015) Vibrational spectroscopic (FTIR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charge analyses of 2-ethylimidazole based on Hartree–Fock and DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 134. 493-501 doi:10.1016/j.saa.2014.06.108
Plain TextArivazhagan, M., Manivel, S., Jeyavijayan, S., Meenakshi, R. (2015) Vibrational spectroscopic (FTIR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charge analyses of 2-ethylimidazole based on Hartree–Fock and DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 134. 493-501 doi:10.1016/j.saa.2014.06.108
In(2015) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 134. Elsevier BV

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Arunagiri, C., Arivazhagan, M., Subashini, A. (2011) Vibrational spectroscopic (FT-IR and FT-Raman), first-order hyperpolarizablity, HOMO, LUMO, NBO, Mulliken charges and structure determination of 2-bromo-4-chlorotoluene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 79 (5) 1747-1756 doi:10.1016/j.saa.2011.05.050
Jeyavijayan, S. (2015) Spectroscopic (FTIR, FT-Raman), molecular electrostatic potential, NBO and HOMO–LUMO analysis of P-bromobenzene sulfonyl chloride based on DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 136. 890-899 doi:10.1016/j.saa.2014.09.110
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