Experimental, DFT Calculation, Biological Activity, Anion Sensing Application Studies and Crystal Structure of (E)-4-[(pyridin-3-ylimino)methyl]benzene-1,3-diol

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dc.authoridKiraz, Askin/0000-0002-2350-8291
dc.authoridUnver, Huseyin/0000-0003-3968-4385
dc.authoridZeyrek, Celal Tugrul/0000-0001-6744-7841
dc.authoridBoyacioglu, Bahadir/0000-0003-3757-3622
dc.contributor.authorUnver, Huseyin
dc.contributor.authorBoyacioglu, Bahadir
dc.contributor.authorZeyrek, Celal Tugrul
dc.contributor.authorYolal, Devrim
dc.contributor.authorYıldız, Mustafa
dc.contributor.authorYildirim, Nuray
dc.contributor.authorDemir, Neslihan
dc.date.accessioned2025-01-27T20:56:22Z
dc.date.available2025-01-27T20:56:22Z
dc.date.issued2018
dc.departmentÇanakkale Onsekiz Mart Üniversitesi
dc.description.abstractCrystallographic and spectroscopic studies of (E)-4-[(pyridin-3-ylimino)methyl]benzene-1,3-diol have been performed. Optimized molecular structure, conformational analysis, theoretical vibrational band assignments, nonlinear optical effects, UV-Vis, properties have also been investigated by using density functional theory with the functional B3LYP using the 6-311++G(d,p) basis set. The antimicrobial activities of the compound were investigated for its minimum inhibitory concentration. The colorimetric response of the Schiff base receptors was investigated before and after the addition of an equivalent amount of each anion to evaluate anion recognition properties. A new Schiff base was prepared and characterized. Experimental and theoretical studies on a new Schiff base have been reported. The tautomeric stability of the compound was investigated by experimental and theoretical (DFT). The nonlinear optical (NLO) effects of the compound was predicted using DFT. The antimicrobial activity and anion-sensor properties of the compound were examined. [GRAPHICS] .
dc.description.sponsorshipScientific and Technical Research Council of Turkey (TUBITAK) [TUBITAK 115F253]
dc.description.sponsorshipThe authors are grateful to the Scientific and Technical Research Council of Turkey (TUBITAK) for the financial support of this work, Grant Number TUBITAK 115F253.
dc.identifier.doi10.1007/s10870-018-0710-x
dc.identifier.endpage46
dc.identifier.issn1074-1542
dc.identifier.issn1572-8854
dc.identifier.issue1-2
dc.identifier.scopus2-s2.0-85046008736
dc.identifier.scopusqualityQ3
dc.identifier.startpage32
dc.identifier.urihttps://doi.org/10.1007/s10870-018-0710-x
dc.identifier.urihttps://hdl.handle.net/20.500.12428/26384
dc.identifier.volume48
dc.identifier.wosWOS:000432995200004
dc.identifier.wosqualityQ4
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherSpringer/Plenum Publishers
dc.relation.ispartofJournal of Chemical Crystallography
dc.relation.publicationcategoryinfo:eu-repo/semantics/openAccess
dc.rightsinfo:eu-repo/semantics/closedAccess
dc.snmzKA_WoS_20250125
dc.subjectSchiff base
dc.subjectDensity functional theory
dc.subjectTautomer
dc.subjectAntimicrobial activities
dc.subjectAnion sensors
dc.titleExperimental, DFT Calculation, Biological Activity, Anion Sensing Application Studies and Crystal Structure of (E)-4-[(pyridin-3-ylimino)methyl]benzene-1,3-diol
dc.typeArticle

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