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Ramalingam, S., Periandy, S., Govindarajan, M., Mohan, S. (2010) FTIR and FTRaman spectra, assignments, ab initio HF and DFT analysis of 4-nitrotoluene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 75 (4) 1308-1314 doi:10.1016/j.saa.2009.12.072

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Reference TypeJournal (article/letter/editorial)
TitleFTIR and FTRaman spectra, assignments, ab initio HF and DFT analysis of 4-nitrotoluene
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsRamalingam, S.Author
Periandy, S.Author
Govindarajan, M.Author
Mohan, S.Author
Year2010 (April)Volume75
Issue4
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2009.12.072Search in ResearchGate
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Mindat Ref. ID16391033Long-form Identifiermindat:1:5:16391033:2
GUID0
Full ReferenceRamalingam, S., Periandy, S., Govindarajan, M., Mohan, S. (2010) FTIR and FTRaman spectra, assignments, ab initio HF and DFT analysis of 4-nitrotoluene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 75 (4) 1308-1314 doi:10.1016/j.saa.2009.12.072
Plain TextRamalingam, S., Periandy, S., Govindarajan, M., Mohan, S. (2010) FTIR and FTRaman spectra, assignments, ab initio HF and DFT analysis of 4-nitrotoluene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 75 (4) 1308-1314 doi:10.1016/j.saa.2009.12.072
In(2010, April) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 75 (4) Elsevier BV

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Tomkinson, John (2010) Comment on: “FTIR and FTRaman spectra, assignments, ab initio HF and DFT analysis of 4-nitrotoluene” by S. Ramalingam et al., Spectrochemica Acta A 75 (2010) 1308–1314. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 77 (2) 539-540 doi:10.1016/j.saa.2010.05.003
Ramalingam, S., Periandy, S., Narayanan, B., Mohan, S. (2010) FTIR and FTRaman spectroscopic investigation of 2-bromo-4-methylaniline using ab initio HF and DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 76 (1) 84-92 doi:10.1016/j.saa.2010.02.050
Ramalingam, S., Periandy, S., Mohan, S. (2010) Vibrational spectroscopy (FTIR and FTRaman) investigation using ab initio (HF) and DFT (B3LYP and B3PW91) analysis on the structure of 2-amino pyridine. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 77 (1) 73-81 doi:10.1016/j.saa.2010.04.027
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Babu, P. David Suresh, Periandy, S., Ramalingam, S. (2011) Vibrational spectroscopic (FTIR and FTRaman) investigation using ab initio (HF) and DFT (LSDA and B3LYP) analysis on the structure of Toluic acid. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (4) 1321-1328 doi:10.1016/j.saa.2011.01.008
Mahadevan, D., Periandy, S., Ramalingam, S. (2011) Vibrational spectroscopy (FTIR and FTRaman) investigation using ab initio (HF) and DFT (B3LYP) calculations on the structure of 3-Bromo phenol. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (2) 575-581 doi:10.1016/j.saa.2010.11.025
Ramalingam, S., Periandy, S., Elanchezhian, B., Mohan, S. (2011) FT-IR and FT-Raman spectra and vibrational investigation of 4-chloro-2-fluoro toluene using ab initio HF and DFT (B3LYP/B3PW91) calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (1) 429-436 doi:10.1016/j.saa.2010.11.005
Arivazhagan, M., Jeyavijayan, S. (2011) FTIR and FT-Raman spectra, assignments, ab initio HF and DFT analysis of xanthine. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 79 (1) 161-168 doi:10.1016/j.saa.2011.02.029
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
Mahadevan, D., Periandy, S., Ramalingam, S. (2011) FT-IR and FT-Raman, vibrational assignments, molecular geometry, ab initio (HF) and DFT (B3LYP) calculations for 1,3-dichlorobenzene. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 79 (5) 962-969 doi:10.1016/j.saa.2011.04.003
Prabhu, T., Periandy, S., Mohan, S. (2011) Spectroscopic (FTIR and FT Raman) analysis and vibrational study on 2,3-dimethyl naphthalene using ab-initio HF and DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (2) 566-574 doi:10.1016/j.saa.2010.11.024
 
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