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金属离子与双氨基二乙酸类(Rida^(2-))配体形成的配合物几何异构体结构的研究 被引量:2
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作者 张鹏 王君 +1 位作者 张维群 李凯 《辽宁大学学报(自然科学版)》 CAS 1996年第4期57-61,共5页
根据角重叠模型(AOM)的方法,计算了六配位八而体cis(N)和trans(N)构型结构的分子轨道能级,并根据此能级计算了所有电子结构的能量。
关键词 配合物 几何异构体 金属离子 双氨基二乙酸
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Synthesis and Crystal Structure of a Dicopper(Ⅰ) Complex with Bis(diphenylphosphino)methane and Diethyldithiocarbamate
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作者 HUANG Shao-Bin② SITU Yue (Department of Applied Chemistry, South China University of Technology, Guangzhou, Guangdong 510640, China) 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2003年第3期260-264,共5页
The title complex [Cu2(-dppm)2(-Et2dtc)](ClO4)EtOH0.25H2O (dppm = bis- (diphenylphosphino)methane, Et2dtc = diethyldithiocarbamate) has been synthesized and characterized by single-crystal X-ray diffraction analysis. ... The title complex [Cu2(-dppm)2(-Et2dtc)](ClO4)EtOH0.25H2O (dppm = bis- (diphenylphosphino)methane, Et2dtc = diethyldithiocarbamate) has been synthesized and characterized by single-crystal X-ray diffraction analysis. The crystal structure is of monoclinic, space group C2/c with a = 42.587(1), b = 14.1653(4), c = 20.5649(5) ? = 105.945(1)? V =11928.6 3, C57H60.5ClCu2NO5.25P4S2, Mr = 1194.09, Z = 8, Dc = 1.330 g/cm3, (MoK) = 0.98 mm-1 and F(000) = 4948. A total of 15243 reflections were collected, of which 7322 were unique. The structure was refined to R = 0.0739 and wR = 0.1846 for 5135 observed reflections with I > 2(I). The crystal structure consists of the complex cation [Cu2(-dppm)2(-Et2dtc)]+, anion ClO4- and solvate H2O and EtOH, where the dinuclear Cu(Ⅰ) atoms are bridged doubly by two dppm ligands and singly by Et2dtc to give three five-membered rings. The Cu(Ⅰ) atom is in an approxi- mately trigonal-planar environment with the P2S chromophore. The short Cu贩稢u separation (2.7111 ? suggests the presence of metal-metal contact. 展开更多
关键词 synthesis crystal structure dicopper complex DIETHYLDITHIOCARBAMATE
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