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dc.creatorShweshein, Khalil Salem A. M.
dc.creatorAndrić, Filip
dc.creatorRadoičić, Aleksandra D.
dc.creatorZlatar, Matija
dc.creatorGruden-Pavlović, Maja
dc.creatorTešić, Živoslav
dc.creatorMilojković-Opsenica, Dušanka
dc.date.accessioned2019-01-30T17:41:43Z
dc.date.available2019-01-30T17:41:43Z
dc.date.issued2014
dc.identifier.issn1537-744X
dc.identifier.urihttp://cer.ihtm.bg.ac.rs/handle/123456789/1538
dc.description.abstractThe lipophilicity of ten ruthenium(II)-arene complexes was assessed by reversed-phase thin-layer chromatography (RP-TLC) on octadecyl silica stationary phase. The binary solvent systems composed of water and acetonitrile were used as mobile phase in order to determine chromatographic descriptors for lipophilicity estimation. Octanol-water partition coefficient, logK(OW), of tested complexes was experimentally determined using twenty-eight standard solutes which were analyzed under the same chromatographic conditions as target substances. In addition, ab initio density functional theory (DFT) computational approach was employed to calculate logK(OW) values from the differences in Gibbs' free solvation energies of the solute transfer from n-octanol to water. A good overall agreement between DFT calculated and experimentally determined logK(OW) values was established (R-2 = 0.8024-0.9658).en
dc.publisherHindawi Publishing Corporation, New York
dc.relationinfo:eu-repo/grantAgreement/MESTD/Basic Research (BR or ON)/172017/RS//
dc.rightsopenAccess
dc.sourceScientific World Journal
dc.titleLipophilicity Assessment of Ruthenium(II)-Arene Complexes by the Means of Reversed-Phase Thin-Layer Chromatography and DFT Calculationsen
dc.typearticle
dc.rights.licenseARR
dcterms.abstractAндриц, Филип; Схwесхеин, Кхалил Салем A. М.; Груден-Павловић, Маја; Милојковиц-Опсеница, Дусанка; Радоициц, Aлександра; Тесиц, Зивослав; Златар, Матија;
dc.citation.other
dc.citation.rankM21
dc.identifier.pmid24587761
dc.identifier.doi10.1155/2014/862796
dc.identifier.rcubrcub_1536
dc.identifier.fulltexthttp://cer.ihtm.bg.ac.rs//bitstream/id/13577/1536.pdf
dc.identifier.scopus2-s2.0-84893984965
dc.identifier.wos000330736300001
dc.type.versionpublishedVersion


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