Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1235911 | Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy | 2007 | 6 Pages |
Abstract
N,Nâ²-(2-Hydroxy-propane-1,3-diyl)-bis(5-nitrosalicylaldiminato-N,O)-copper(II) has been synthesized. The crystal structure has been determined by X-ray diffraction analysis, and linear optical characterization has been determined by UV-vis spectroscopy. It was found that the molecule under investigation has solvatochromic behaviour in the UV region, implying non-zero microscopic first hyperpolarizability. To reveal the microscopic nonlinear optical (NLO) properties, the static first hyperpolarizabilities (β) and the electric dipole moments (μ) were evaluated by using the ab initio finite field (FF) method. According to the results of the FF calculations, the synthesized compound exhibits non-zero β values, and it might have microscopic NLO behaviour.
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Physical Sciences and Engineering
Chemistry
Analytical Chemistry
Authors
Emine Donmez, Hulya Kara, Aslı KarakaÅ, Hüseyin Ãnver, Ayhan Elmali,