Watch the Dallas Symposium LIVE, and fundraiser auction
Ticket proceeds support mindat.org! - click here...
Log InRegister
Quick Links : The Mindat ManualThe Rock H. Currier Digital LibraryMindat Newsletter [Free Download]
Home PageAbout MindatThe Mindat ManualHistory of MindatCopyright StatusWho We AreContact UsAdvertise on Mindat
Donate to MindatCorporate SponsorshipSponsor a PageSponsored PagesMindat AdvertisersAdvertise on Mindat
Learning CenterWhat is a mineral?The most common minerals on earthInformation for EducatorsMindat ArticlesThe ElementsThe Rock H. Currier Digital LibraryGeologic Time
Minerals by PropertiesMinerals by ChemistryAdvanced Locality SearchRandom MineralRandom LocalitySearch by minIDLocalities Near MeSearch ArticlesSearch GlossaryMore Search Options
Search For:
Mineral Name:
Locality Name:
Keyword(s):
 
The Mindat ManualAdd a New PhotoRate PhotosLocality Edit ReportCoordinate Completion ReportAdd Glossary Item
Mining CompaniesStatisticsUsersMineral MuseumsClubs & OrganizationsMineral Shows & EventsThe Mindat DirectoryDevice SettingsThe Mineral Quiz
Photo SearchPhoto GalleriesSearch by ColorNew Photos TodayNew Photos YesterdayMembers' Photo GalleriesPast Photo of the Day GalleryPhotography

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

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleFTIR and FTRaman spectroscopic investigation of 2-bromo-4-methylaniline using ab initio HF and DFT calculations
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsRamalingam, S.Author
Periandy, S.Author
Narayanan, B.Author
Mohan, S.Author
Year2010 (June)Volume76
Issue1
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2010.02.050Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID16391107Long-form Identifiermindat:1:5:16391107:0
GUID0
Full ReferenceRamalingam, 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
Plain TextRamalingam, 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
In(2010, June) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 76 (1) Elsevier BV

See Also

These are possibly similar items as determined by title/reference text matching only.

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., 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
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
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
Ramalingam, S., Periandy, S. (2011) Vibrational spectroscopy [FTIR and FTRaman] investigation, computed vibrational frequency analysis and IR intensity and Raman activity peak resemblance analysis on 4-chloro 2-methylaniline using HF and DFT [LSDA, B3LYP and B3PW91] calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (3) 1149-1161 doi:10.1016/j.saa.2010.12.068
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
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
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. (2011) Spectroscopic investigation, computed IR intensity, Raman activity and vibrational frequency analysis on 3-bromoanisole using HF and DFT (LSDA/MPW1PW91) calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (2) 835-843 doi:10.1016/j.saa.2010.12.043
Shakila, G., Periandy, S., Ramalingam, S. (2011) Molecular structure and vibrational analysis of 3-Ethylpyridine using ab initio HF and density functional theory (B3LYP) calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (2) 732-739 doi:10.1016/j.saa.2010.12.005
Mahadevan, D., Periandy, S., Karabacak, M., Ramalingam, S. (2011) FT-IR and FT-Raman, UV spectroscopic investigation of 1-bromo-3-fluorobenzene using DFT (B3LYP, B3PW91 and MPW91PW91) calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 82 (1) 481-492 doi:10.1016/j.saa.2011.07.082
 
and/or  
Mindat.org is an outreach project of the Hudson Institute of Mineralogy, a 501(c)(3) not-for-profit organization.
Copyright © mindat.org and the Hudson Institute of Mineralogy 1993-2025, except where stated. Most political location boundaries are © OpenStreetMap contributors. Mindat.org relies on the contributions of thousands of members and supporters. Founded in 2000 by Jolyon Ralph.
To cite: Ralph, J., Von Bargen, D., Martynov, P., Zhang, J., Que, X., Prabhu, A., Morrison, S. M., Li, W., Chen, W., & Ma, X. (2025). Mindat.org: The open access mineralogy database to accelerate data-intensive geoscience research. American Mineralogist, 110(6), 833–844. doi:10.2138/am-2024-9486.
Privacy Policy - Terms & Conditions - Contact Us / DMCA issues - Report a bug/vulnerability Current server date and time: August 17, 2025 22:16:18
Go to top of page