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

Hernández, V., Ramírez, F. J., Casado, J., López Navarrete, J. T. (1996) Scaled Quantum-Mechanical Force Field and Vibrational Spectra of 3-Methylthiophene. The Journal of Physical Chemistry, 100 (8). 2907-2914 doi:10.1021/jp952961j

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleScaled Quantum-Mechanical Force Field and Vibrational Spectra of 3-Methylthiophene
JournalThe Journal of Physical Chemistry
AuthorsHernández, V.Author
Ramírez, F. J.Author
Casado, J.Author
López Navarrete, J. T.Author
Year1996 (January)Volume100
Issue8
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jp952961jSearch in ResearchGate
Generate Citation Formats
Mindat Ref. ID8045490Long-form Identifiermindat:1:5:8045490:6
GUID0
Full ReferenceHernández, V., Ramírez, F. J., Casado, J., López Navarrete, J. T. (1996) Scaled Quantum-Mechanical Force Field and Vibrational Spectra of 3-Methylthiophene. The Journal of Physical Chemistry, 100 (8). 2907-2914 doi:10.1021/jp952961j
Plain TextHernández, V., Ramírez, F. J., Casado, J., López Navarrete, J. T. (1996) Scaled Quantum-Mechanical Force Field and Vibrational Spectra of 3-Methylthiophene. The Journal of Physical Chemistry, 100 (8). 2907-2914 doi:10.1021/jp952961j
In(1996, January) The Journal of Physical Chemistry Vol. 100 (8) American Chemical Society (ACS)

See Also

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

Hernández, V., Casado, J., Ramírez, F. J., Alemany, L. J., Hotta, Shu, López Navarrete, J. T. (1996) Conformational Disorder and Mean Conjugation of Neutral α,α‘-Dimethyl End-Capped Oligothiophenes in Solution:  A FT-Raman and FT-Infrared Spectroscopic Study. The Journal of Physical Chemistry, 100 (1). 289-293 doi:10.1021/jp951628c
Hernández, V., Casado, J., Ramírez, F. J., Zotti, G., Hotta, Shu, López Navarrete, J. T. (1996) Efficient π electrons delocalization in α,α′‐dimethyl end‐capped oligothiophenes: A vibrational spectroscopic study. The Journal of Chemical Physics, 104 (23). 9271-9282 doi:10.1063/1.471674
Navarrete, J. T. López, Hernández, V., Ramírez, F. J. (1994) Vibrational spectra of [15N]glutamic acid and [2H4]glutamic acid. Journal of Raman Spectroscopy, 25 (11). 861-867 doi:10.1002/jrs.1250251104
López Navarrete, J. T., Casado, J., Hernández, V., Ramírez, F. J. (1997) Experimental and theoretical vibrational studies of the amino acidl-asparagine in solution. Journal of Raman Spectroscopy, 28 (7). 501-509 doi:10.1002/(sici)1097-4555(199707)28:7<501::aid-jrs117>3.0.co;2-b
Hernández, V., Ramírez, F.J., Casado, J., Enríquez, F., Quirante, J.J., Navarrete, J.T.López (1997) Ab initio theoretical study of thiophene derivatives: 2-methylthiophene and 3-methylthiophene. Journal of Molecular Structure, 410. 311-314 doi:10.1016/s0022-2860(96)09469-0
Ramírez, F. J., Hernández, V., Navarrete, J. T. López (1994) Transferable semiempirical quadratic force fields: The case of polythiophene and shorter oligomers. Journal of Computational Chemistry, 15 (4). 405-423 doi:10.1002/jcc.540150405
Casado, J., Hernández, V., Ramírez, F.J., Navarrete, J.T. López (1997) A theoretical investigation of α,α′-dimethyl end-capped oligothiophenes: structures, vibrational spectra and conjugation defects. Synthetic Metals, 89 (2). 159-160 doi:10.1016/s0379-6779(98)80120-3
Hernández, V., Casado, J., Effenberger, F., López Navarrete, J. T. (2000) Analysis of the intramolecular charge transfer in donor–acceptor α,α′-substituted oligothiophenes from their vibrational spectra. The Journal of Chemical Physics, 112 (11). 5105-5112 doi:10.1063/1.481066
Hernández, V., Casado, J., Ramírez, F.J., Zotti, G., Hotta, Shu, López Navarrete, J.T. (1996) Delocalization length, electronic properties and vibrational spectra of neutral α,α′ -dimethyl end-capped oligothiophenes. Synthetic Metals, 76 (1). 277-280 doi:10.1016/0379-6779(95)03470-5
Nieto-Ortega, Belén, Nebot, Vicent J., Miravet, Juan F., Escuder, Beatriu, Navarrete, Juan T. López, Casado, Juan, Ramírez, Francisco J. (2012) Vibrational Circular Dichroism Shows Reversible Helical Handedness Switching in Peptidomimetic l-Valine Fibrils. The Journal of Physical Chemistry Letters, 3 (16). 2120-2124 doi:10.1021/jz300725d
Casado, J., Hernández, V., Ramírez, F.J., Navarrete, J.T. López (1997) A theoretical investigation of α,α′-dimethyl end-capped oligothiophenes: Structures, vibrational spectra and conjugational defects. Synthetic Metals, 85 (1). 1157-1158 doi:10.1016/s0379-6779(97)80193-2
 
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 28, 2025 00:57:29
Go to top of page