Study on the second order optical properties of N-(2,4-dichloro)-salicylaldimine

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dc.contributor.authorKarakas, A
dc.contributor.authorUnver, H
dc.contributor.authorElmali, A
dc.contributor.authorSvoboda, I
dc.date.accessioned2020-03-26T16:58:01Z
dc.date.available2020-03-26T16:58:01Z
dc.date.issued2005
dc.departmentSelçuk Üniversitesien_US
dc.description.abstractN-(2,4-Dichloro)-salicylaldimine was synthesized, characterized by elemental analysis, FT-IR, and UV-visible spectroscopy, and its crystal structure was determined. The title compound is almost planar and contains short intramolecular O-H center dot center dot center dot N hydrogen bonds [O1-N1 2.601(1) A]. It remains transparent in the visible region and has solvatochromic behavior in the UV region in the range 198 349 nm, implying non-zero microscopic first hyperpolarizability. The ab-initio quantum mechanical calculations (finite field second-order Moller Plesset perturbation theory) of the studied compound have been carried out to compute the electric dipole moment (mu) and the first hyperpolarizability (beta) values. The ab-initio results also show that this ligand might have microscopic nonlinear optical behavior with non-zero values.en_US
dc.identifier.endpage382en_US
dc.identifier.issn0932-0784en_US
dc.identifier.issue5en_US
dc.identifier.startpage376en_US
dc.identifier.urihttps://hdl.handle.net/20.500.12395/19887
dc.identifier.volume60en_US
dc.identifier.wosWOS:000229779400010en_US
dc.identifier.wosqualityQ3en_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.language.isoenen_US
dc.publisherVERLAG Z NATURFORSCHen_US
dc.relation.ispartofZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCESen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.selcuk20240510_oaigen_US
dc.subjectnonlinear opticsen_US
dc.subjectfirst hyperpolarizabilityen_US
dc.subjectUV-visible spectroscopyen_US
dc.subjectcrystal structureen_US
dc.subjectab-initio calculationen_US
dc.titleStudy on the second order optical properties of N-(2,4-dichloro)-salicylaldimineen_US
dc.typeArticleen_US

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