首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >catena-Polytetra­kis(μ2-acetato-κ2 O:O′)dicopper(II)(Cu—Cu)-μ2-acetato-κ2 O:O′-bis­μ2-3-(dimethyl­amino)propan-1-olato-κ2 NO:O;κ2 O:NO-bis­(tetra­hydro­furan-κO)copper(II)-μ2-acetato-κ2 O:O′
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catena-Polytetra­kis(μ2-acetato-κ2 O:O′)dicopper(II)(Cu—Cu)-μ2-acetato-κ2 O:O′-bis­μ2-3-(dimethyl­amino)propan-1-olato-κ2 NO:O;κ2 O:NO-bis­(tetra­hydro­furan-κO)copper(II)-μ2-acetato-κ2 O:O′

机译:阳离子多聚体tetrakis(μ2-acetato-κ2) O:O)双铜(II)(Cu – Cu)-μ2-acetato-κ2 O:O′-双μ2-3-(二甲氨基)丙-1-醇-κ2 NO:O;κ2 O:NO-双(四氢呋喃-κO)铜(II)-μ2-acetato-κ2 O:O′

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摘要

The title complex, [Cu4(C5H12NO)2(C2H3O2)6(C4H8O)2]n, consists of dinuclear [Cu2(C5H12NO)2(THF)2] (THF is tetra­hydro­furan) and [Cu2(CH3COO)4] units linked through acetate ions, generating parallel one-dimensional polymeric chains propagating in the [10] direction. In the first dinuclear unit, CuII ions related by inversion symmetry are bridged by two 3-(dimethyl­amino)propan-1-olate ligands. Likewise, a pair of inversion-related CuII ions are bridged by four acetate groups. The crystallographically independent Cu centers are linked to one another by a single bridging acetate group, generating an infinite chain. The distorted square-pyramidal coordination of the first metal center is completed with an apical THF mol­ecule, with a long Cu—O bond length of 2.476 (5) Å. The geometry around the other metal atom is close to octa­hedral, and the Cu⋯Cu separation in this unit is 2.652 (1) Å. The distance between the metal centers in the first dinuclear unit is considerably longer [3.068 (1) Å], suggesting little or no bonding inter­action. The Cu⋯Cu separation between two acetate-bridged independent Cu centers is 4.860 (2) Å. The THF mol­ecule has methyl­ene groups disordered over two positions, with occupancies of 0.608 (13) and 0.392 (13).
机译:标题化合物[Cu4(C5H12NO)2(C2H3O2)6(C4H8O)2] n由双核[Cu2(C5H12NO)2(THF) 2 ](THF为四氢呋喃)和通过乙酸根离子连接的 2 (CH 3 COO) 4 ]单元,生成在[10]方向上传播的平行一维聚合物链。在第一个双核单元中,通过反转对称性关联的Cu II 离子被两个3-(二甲基­氨基)丙烷-1-油酸酯配体桥接。同样,一对与反转有关的Cu II 离子被四个乙酸酯基桥接。晶体学上独立的Cu中心通过一个桥接的乙酸酯基相互连接,生成无限链。第一金属中心的扭曲的方金字塔形配位是通过顶端THF分子完成的,其长的Cu-O键长度为2.476(5)Å。另一个金属原子周围的几何形状接近八面体,本单元中的Cu⋯Cu间距为2.652(1)Å。第一个双核单元中金属中心之间的距离要长得多[3.068(1)Å],表明键间相互作用很小或没有。两个乙酸盐桥联的独立Cu中心之间的Cu⋯Cu间距为4.860(2)Å。 THF分子具有在两个位置上无序的亚甲基基团,占有率为0.608 0.6(13)和0.392(13)。

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