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Calculation and analysis of IR spectrum of 2-aminopyridine

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dc.contributorFen Edebiyat Fakültesi / Faculty of Letters and Sciences Fizik / Physicstr_TR
dc.contributor.authorAkalın, Elif
dc.contributor.authorBüyükmurat, Y.
dc.contributor.authorÖzel, Ayşen E.
dc.contributor.authorAKYÜZ, SEVİM
dc.contributor.authorID46357tr_TR
dc.contributor.authorID110745tr_TR
dc.contributor.authorID10127tr_TR
dc.date.accessioned2018-08-31T12:14:49Z
dc.date.available2018-08-31T12:14:49Z
dc.date.issued1999-05-25
dc.description.abstractNormal coordinate analysis of 2-aminopyridine (2AP) and ND2-pyridine have been performed in valance force field approximation. 2AP was taken as planar because of the low barrier to amino group inversion. The IR absorption intensities have been calculated and the electro–optical parameters (EOP) were fitted to experimental data in order to produce the experimental relative intensities. The created force field and EOP reproduce the IR spectrum of the molecule studied well.tr_TR
dc.identifier.urihttps://doi.org/10.1016/S0022-2860(99)00022-8
dc.identifier.urihttps://hdl.handle.net/11413/2578
dc.language.isoen_UStr_TR
dc.publisherElseviertr_TR
dc.relationJournal of Molecular Structuretr_TR
dc.subjectNormal coordinate analysistr_TR
dc.subject2-aminopyridinetr_TR
dc.subjectIR spectrumtr_TR
dc.subjectForce fieldtr_TR
dc.subjectElectro–optical parameterstr_TR
dc.titleCalculation and analysis of IR spectrum of 2-aminopyridinetr_TR
dc.typeArticletr_TR
dspace.entity.typePublication
relation.isAuthorOfPublication70600e97-ae14-4ca5-b357-0fd647a25331
relation.isAuthorOfPublication.latestForDiscovery70600e97-ae14-4ca5-b357-0fd647a25331

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