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

Balachandran, V., Santhi, G., Karpagam, V. (2013) Spectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO–LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 106. 262-274 doi:10.1016/j.saa.2013.01.011

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleSpectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO–LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde
JournalSpectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
AuthorsBalachandran, V.Author
Santhi, G.Author
Karpagam, V.Author
Year2013 (April)Volume106
PublisherElsevier BV
DOIdoi:10.1016/j.saa.2013.01.011Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID16393700Long-form Identifiermindat:1:5:16393700:1
GUID0
Full ReferenceBalachandran, V., Santhi, G., Karpagam, V. (2013) Spectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO–LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 106. 262-274 doi:10.1016/j.saa.2013.01.011
Plain TextBalachandran, V., Santhi, G., Karpagam, V. (2013) Spectroscopic (FT-IR and FT-Raman) studies, NBO, HOMO–LUMO, NMR analyses and thermodynamics functions of 5-bromo-2-methoxybenzaldehyde. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 106. 262-274 doi:10.1016/j.saa.2013.01.011
In(2013) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy Vol. 106. Elsevier BV

See Also

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

Balachandran, V., Santhi, G., Karpagam, V., Lakshmi, A. (2013) Molecular structure, spectroscopic (FT-IR, FT-Raman), NBO and HOMO–LUMO analyses, computation of thermodynamic functions for various temperatures of 2, 6-dichloro-3-nitrobenzoic acid. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 110. 130-140 doi:10.1016/j.saa.2013.03.021
Balachandran, V., Karunakaran, V. (2013) Quantum mechanical study of the structure and vibrational spectroscopic (FT-IR and FT-Raman), first-order hyperpolarizability, NBO and HOMO−LUMO studies of 4-bromo-3-nitroanisole. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 106. 284-298 doi:10.1016/j.saa.2012.12.070
Balachandran, V., Murugan, M., Karpagam, V., Karnan, M., Ilango, G. (2014) Conformational stability, spectroscopic (FT-IR & FT-Raman), HOMO–LUMO, NBO and thermodynamic function of 4-(trifloromethoxy) phenol. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 130. 367-375 doi:10.1016/j.saa.2014.04.043
Balachandran, V., Nataraj, A., Karthick, T. (2013) Molecular structure, spectroscopic (FT-IR, FT-Raman) studies and first-order molecular hyperpolarizabilities, HOMO–LUMO, NBO analysis of 2-hydroxy-p-toluic acid. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 104. 114-129 doi:10.1016/j.saa.2012.11.052
Balachandran, V., Mahalakshmi, G., Lakshmi, A., Janaki, A. (2012) DFT, FT-Raman, FT-IR, HOMO–LUMO and NBO studies of 4-Methylmorpholine. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 97. 1101-1110 doi:10.1016/j.saa.2012.07.112
Karunakaran, V., Balachandran, V. (2012) FT-IR, FT-Raman spectra, NBO, HOMO–LUMO and thermodynamic functions of 4-chloro-3-nitrobenzaldehyde based on ab initio HF and DFT calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 98. 229-239 doi:10.1016/j.saa.2012.08.003
Karnan, M., Balachandran, V., Murugan, M., Murali, M.K., Nataraj, A. (2013) Vibrational (FT-IR and FT-Raman) spectra, NBO, HOMO–LUMO, Molecular electrostatic potential surface and computational analysis of 4-(trifluoromethyl)benzylbromide. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 116. 84-95 doi:10.1016/j.saa.2013.06.120
Balachandran, V., Karpagam, V., Santhi, G., Revathi, B., Ilango, G., Kavimani, M. (2015) Conformational stability, vibrational (FT-IR and FT-Raman) spectra and computational analysis of m-trifluoromethyl benzoic acid. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 137. 165-175 doi:10.1016/j.saa.2014.08.086
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
Prabavathi, N., Nilufer, A., Krishnakumar, V. (2013) Spectroscopic (FT-IR, FT-Raman, UV and NMR) investigation, conformational stability, NLO properties, HOMO–LUMO and NBO analysis of hydroxyquinoline derivatives by density functional theory calculations. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 114. 449-474 doi:10.1016/j.saa.2013.05.011
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
 
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 19, 2025 10:58:39
Go to top of page