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dc.creatorMatijevic, Borko M.
dc.creatorVastag, Dendi D.
dc.creatorPerisic-Janjic, Nada U.
dc.creatorApostolov, Suzana Lj
dc.creatorMilčić, Miloš K.
dc.creatorZivanovic, Lidija
dc.creatorMarinković, Aleksandar
dc.date.accessioned2018-11-22T00:26:48Z
dc.date.available2018-11-22T00:26:48Z
dc.date.issued2014
dc.identifier.issn1386-1425
dc.identifier.urihttp://cherry.chem.bg.ac.rs/handle/123456789/1454
dc.description.abstractUV absorption spectra of N-(substituted phenyl)-2-cyanoacetamides have been recorded in the range 200-400 nm in the set of selected solvents. The solute-solvent interactions were analyzed on the basis of linear solvation energy relationships (LSER) concept proposed by Kamlet and Taft. The effects of substituents on the absorption spectra were interpreted by correlation of absorption frequencies with Hammett substituent constant, sigma. It was found that substituents significantly change the extent of conjugation. Furthermore, the experimental findings were interpreted with the aid of ab initio B3LYP/6-311G(d,p) method. Electronic energies was calculated by the use of 6-311++G(3df,3pd) methods with standard polarized continuum model (PCM) for inclusion of the solvent effect. (C) 2013 Elsevier B.V. All rights reserved.en
dc.publisherPergamon-Elsevier Science Ltd, Oxford
dc.relationinfo:eu-repo/grantAgreement/MESTD/Basic Research (BR or ON)/172013/RS//
dc.rightsrestrictedAccess
dc.sourceSpectrochimica Acta. Part A: Molecular and Biomolecular Spectroscopy
dc.subjectN-(substituted phenyl)-2-cyanoacetamidesen
dc.subjectUV absorption spectraen
dc.subjectSolvent effectsen
dc.subjectSubstituent effectsen
dc.subjectAb initio MO calculationen
dc.titleSolvent and structural effects on the UV absorption spectra of N-(substituted phenyl)-2-cyanoacetamidesen
dc.typearticle
dc.rights.licenseARR
dcterms.abstractПерисиц-Јањиц, Нада У.; Матијевиц, Борко М.; Вастаг, Денди Д.; Aпостолов, Сузана Љ; Милчић, Милош; Маринковиц, Aлександар Д.; Зивановиц, Лидија;
dc.citation.volume117
dc.citation.spage568
dc.citation.epage575
dc.identifier.wos000328179900075
dc.identifier.doi10.1016/j.saa.2013.08.040
dc.citation.other117: 568-575
dc.citation.rankM22
dc.identifier.pmid24041496
dc.type.versionpublishedVersionen
dc.identifier.scopus2-s2.0-84883736756
dc.identifier.rcubKon_2574


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