Synthesis, structure, spectroscopic studies and ab-initio calculations on first hyperpolarizabilities of NN '-bis(2-hydroxy-1-naphthyl-methylidene)-1-methyl-1,2-diaminoethane-N,N ',O,O '-copper(II)

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dc.contributor.authorKarakas, Ash
dc.contributor.authorElmali, Ayhan
dc.contributor.authorUnver, Huseyin
dc.contributor.authorKara, Hulya
dc.contributor.authorYahsi, Yasemin
dc.date.accessioned2020-03-26T17:04:27Z
dc.date.available2020-03-26T17:04:27Z
dc.date.issued2006
dc.departmentSelçuk Üniversitesien_US
dc.description.abstractN,N'-Bis(2-hydroxy-1-naphthylmethylidene)-1-methyl-1,2-diaminoethane-N,N',O,O'-copper(II) has been synthesized, and characterized by FT-IR and UV/vis spectroscopies. Its crystal structure has been determined by X-ray diffraction analysis. The maximum absorption wavelengths recorded by linear optical experiments are estimated in the UV region to be shorter than 450 nm, showing good optical transparency to the visible light. It may thus possess first hyperpolarizabilities with non-zero values for nonlinear optical (NLO) applications. Ab-initio quantum chemical calculations of the electric dipole moments (mu) and the first static hyperpolarizabilities (0) were carried out. The computational results suggest that the complex may indeed have microscopic NLO behavior with non-zero values.en_US
dc.identifier.endpage974en_US
dc.identifier.issn0932-0776en_US
dc.identifier.issn1865-7117en_US
dc.identifier.issue8en_US
dc.identifier.startpage968en_US
dc.identifier.urihttps://hdl.handle.net/20.500.12395/20705
dc.identifier.volume61en_US
dc.identifier.wosWOS:000240223800007en_US
dc.identifier.wosqualityQ3en_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.language.isoenen_US
dc.publisherWALTER DE GRUYTER GMBHen_US
dc.relation.ispartofZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCESen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.selcuk20240510_oaigen_US
dc.subjectcopper(II) complexen_US
dc.subjectUV-visible spectroscopyen_US
dc.subjectcrystal structureen_US
dc.subjectfirst hyperpolarizabilityen_US
dc.subjectelectric dipole momenten_US
dc.titleSynthesis, structure, spectroscopic studies and ab-initio calculations on first hyperpolarizabilities of NN '-bis(2-hydroxy-1-naphthyl-methylidene)-1-methyl-1,2-diaminoethane-N,N ',O,O '-copper(II)en_US
dc.typeArticleen_US

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