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Suvitha, A., Periandy, S., Gayathri, P. (2015) NBO, HOMO–LUMO, UV, NLO, NMR and vibrational analysis of veratrole using FT-IR, FT-Raman, FT-NMR spectra and HF–DFT computational methods. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 138. 357-369 doi:10.1016/j.saa.2014.11.011

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Reference TypeJournal (article/letter/editorial)
TitleNBO, HOMO–LUMO, UV, NLO, NMR and vibrational analysis of veratrole using FT-IR, FT-Raman, FT-NMR spectra and HF–DFT computational methods
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsSuvitha, A.Author
Periandy, S.Author
Gayathri, P.Author
Year2015 (March)Volume138
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2014.11.011Search in ResearchGate
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Mindat Ref. ID16396657Long-form Identifiermindat:1:5:16396657:5
GUID0
Full ReferenceSuvitha, A., Periandy, S., Gayathri, P. (2015) NBO, HOMO–LUMO, UV, NLO, NMR and vibrational analysis of veratrole using FT-IR, FT-Raman, FT-NMR spectra and HF–DFT computational methods. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 138. 357-369 doi:10.1016/j.saa.2014.11.011
Plain TextSuvitha, A., Periandy, S., Gayathri, P. (2015) NBO, HOMO–LUMO, UV, NLO, NMR and vibrational analysis of veratrole using FT-IR, FT-Raman, FT-NMR spectra and HF–DFT computational methods. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 138. 357-369 doi:10.1016/j.saa.2014.11.011
In(2015) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 138. Elsevier BV

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Carthigayan, K., Xavier, S., Periandy, S. (2015) HOMO–LUMO, UV, NLO, NMR and vibrational analysis of 3-methyl-1-phenylpyrazole using FT-IR, FT-RAMAN FT-NMR spectra and HF-DFT computational methods. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 142. 350-363 doi:10.1016/j.saa.2015.02.035
Suvitha, A., Periandy, S., Boomadevi, S., Govindarajan, M. (2014) Vibrational frequency analysis, FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO–LUMO and electronic structure calculations on pycolinaldehyde oxime. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 117. 216-224 doi:10.1016/j.saa.2013.07.080
Govindarajan, M., Karabacak, M., Periandy, S., Tanuja, D. (2012) Spectroscopic (FT-IR, FT-Raman, UV and NMR) investigation and NLO, HOMO–LUMO, NBO analysis of organic 2,4,5-trichloroaniline. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 97. 231-245 doi:10.1016/j.saa.2012.06.014
Govindarajan, M., Karabacak, M., Suvitha, A., Periandy, S. (2012) FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO–LUMO and electronic structure calculations on 4-chloro-3-nitrotoluene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 89. 137-148 doi:10.1016/j.saa.2011.12.067
Mathammal, R., Monisha, N.R., Yasaswini, S., Krishnakumar, V. (2015) Molecular structure, vibrational analysis (FT-IR, FT-Raman), NMR, UV, NBO and HOMO–LUMO analysis of N,N-Diphenyl Formamide based on DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 139. 521-532 doi:10.1016/j.saa.2014.11.057
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Sivaranjani, T., Xavier, S., Periandy, S. (2015) NMR, FT-IR, FT-Raman, UV spectroscopic, HOMO–LUMO and NBO analysis of cumene by quantum computational methods. Journal of Molecular Structure, 1083. 39-47 doi:10.1016/j.molstruc.2014.11.035
 
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