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掺杂 Cu(2+) 离子在 [Zn(sac)(2)(en)(2)] 单晶中的晶体结构和 EPR 研究。

Crystal structure and EPR studies of doped Cu(2+) ion in [Zn(sac)(2)(en)(2)] single crystal.

机构信息

Department of Physics, Faculty of Arts and Sciences, Ondokuz Mayis University, Samsun, Turkey.

出版信息

Spectrochim Acta A Mol Biomol Spectrosc. 2010 Apr;75(4):1195-9. doi: 10.1016/j.saa.2009.10.038. Epub 2009 Nov 18.

DOI:10.1016/j.saa.2009.10.038
PMID:20138801
Abstract

The tran-bis(ethylenediamine)bis(saccharinato)Zinc(II), [Zn(sac)(2)(en)(2)] (ZSED), (en: ethylenediamine and sac: saccharinate) complex has been synthesized and its crystal structure has been determined by X-ray diffraction analysis. The compound crystallizes in space group P2(1)/c. The Zn(II) ion is hexa-coordinated by four nitrogens of two bidentate en ligands composing the basal plane and two nitrogen atoms from the monodentate two sac ligands (N-bonded) occuping the axial sites, adopting an elongated octahedral sphere. Both en and sac ligands occupy the trans positions of the coordination octahedron. The Zn(II) ion in title compound sits on a inversion centre and is octahedrally coordinated two bidentate en (ethylenediamine) and two sac (saccharinate) (N-bonded) ligands. The magnetic environments of Cu(2+) doped [Zn(sac)(2)(en)(2)] complex have been identified by electron paramagnetic resonance (EPR) technique. Cu(2+) doped ZSED single crystals have been studied at room temperature in three mutually perpendicular planes. The calculated results of the Cu(2+) doped ZSED indicate that Cu(2+) ion contains two magnetically inequivalent Cu(2+) sites in distinct orientations occupying substitutional positions in the host lattice and show very high angular dependence.

摘要

反式-双(乙二胺)双(酒石酸根合)锌(II)配合物,[Zn(sac)(2)(en)(2)](ZSED)(en:乙二胺,sac:酒石酸根)的合成及其晶体结构已通过 X 射线衍射分析确定。该化合物在空间群 P2(1)/c 中结晶。Zn(II)离子被两个双齿 en 配体的四个氮原子和两个单齿 sac 配体(N 键合)的两个氮原子六配位,形成拉长的八面体。en 和 sac 配体都占据配位八面体的反位。标题化合物中的 Zn(II)离子位于反演中心,被两个双齿 en(乙二胺)和两个 sac(酒石酸根)(N 键合)配体八配位。通过电子顺磁共振(EPR)技术确定了 Cu(2+)掺杂[Zn(sac)(2)(en)(2)]配合物的磁环境。在三个相互垂直的平面上研究了室温下 Cu(2+)掺杂 ZSED 单晶。Cu(2+)掺杂 ZSED 的计算结果表明,Cu(2+)离子在取代位置上占据了宿主晶格中两个不同取向的磁不等价 Cu(2+)位,表现出非常高的角度依赖性。

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