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dc.contributor.authorKeypour, Hassan
dc.contributor.authorShayesteh, Maryam
dc.contributor.authorRezaeivala, Majid
dc.contributor.authorSayin, Koray
dc.descriptionWOS: 000372381400014en_US
dc.description.abstractThree new dinuclear copper complexes were synthesized via condensation reaction of three new unsymmetrical N-capped tripodal amines and. 2,6-diformy1-4-methylphenol, in the presence of copper(II) perchlorate. The solid-state structure of the dinuclear complex, [Cu2L1](ClO4)(2,) has been determined by X-ray crystallography, showing that the Cu-II centers have distorted square-pyramidal geometry with N3O2 coordination. The copper (II) ions are bridged by phenolic and hydroxyalkyl groups when in both cases, deprotonation of the hydrogen atoms of the OH groups occurs. The distance between the copper atoms is 3.062 angstrom. This compound consists of the dication [Cu2L1](2+) and two ClO4- anions in which one of ClO4- groups has a week interaction with one of the Cu atoms. All complexes were characterized by a variety of physico-chemical techniques such as elemental analyses, IR, mass spectra, conductivity measurements and electronic spectral studies. Computational investigation of mentioned binuclear Cu(II) complexes was done by using M062X method with LANL2DZ basis set in vacuo. (C) 2016 Elsevier B.V. All rights reserved.en_US
dc.description.sponsorshipFaculty of Chemistry of Bu-Ali Sina University, Ministry of Science, Research and Technology of Iran; MacDiarmid Institute for Advanced Materials and Nanotechnology; office of scientific research projects of Cumhuriyet University [F-429]; University of Otagoen_US
dc.description.sponsorshipWe are grateful to the Faculty of Chemistry of Bu-Ali Sina University, Ministry of Science, Research and Technology of Iran, the University of Otago and the MacDiarmid Institute for Advanced Materials and Nanotechnology for financial support (PhD scholarship for SD), and Professor Sally Brooker for hosting MS for a 6 month research visit. Also, we are grateful of the office of scientific research projects of Cumhuriyet University (Project No.: F-429) for financial supports. The numerical calculations reported in this paper are performed at TUBITAK ULAKBIM, High Performance and Grid Computing Center (TRUBA Resources).en_US
dc.subjectBinuclear Cu complexesen_US
dc.subjectCompartmental Schiff base ligandsen_US
dc.subjectUnsymmetrical tripodal aminesen_US
dc.subjectX-ray crystal structureen_US
dc.subjectTheoretical studiesen_US
dc.titleDinuclear Cu(II) complexes of compartmental Schiff base ligands formed from unsymmetrical tripodal amines of varying arm lengths: Crystal structure of [Cu2L1](ClO4)(2) and theoretical studiesen_US
dc.contributor.department[Keypour, Hassan -- Shayesteh, Maryam] Bu Ali Sina Univ, Fac Chem, Hamadan 65174, Iran -- [Rezaeivala, Majid] Hamedan Univ Technol, Dept Chem Engn, Hamadan 65155, Iran -- [Sayin, Koray] Cumhuriyet Univ, Inst Sci, Dept Chem, TR-58140 Sivas, Turkeyen_US
dc.contributor.authorIDkeypour, Hassan -- 0000-0001-9973-241Xen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US

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