首页> 美国卫生研究院文献>Acta Crystallographica Section E: Crystallographic Communications >catena-Polyaqua­zinc(II)-μ-NN′-bis­(2-cyano-3-eth­oxy-3-oxoprop-1-en­yl)benzene-12-diaminido
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catena-Polyaqua­zinc(II)-μ-NN′-bis­(2-cyano-3-eth­oxy-3-oxoprop-1-en­yl)benzene-12-diaminido

机译:阳离子-聚水合锌(II)-μ-NN-双­(2-氰基-3-乙氧基-3-氧代丙-1-烯丙基)苯-12-二胺基

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摘要

The slightly yellow-coloured title complex, [Zn(C18H16N4O4)(H2O)]n, crystallizes with one mol­ecule in the asymmetric unit. The structure clearly shows the mer-η4 O,O,N,N-binding mode of the N,N′-bis-(2-cyano-ethyl­propeno­yl)-1,2-di­amido­benzene ligand stabilizing the Zn centre of a distorted octa­hedral environment. The fifth coordination site in one apical position is held by a coordinating solvent water mol­ecule whereas the complete octa­hedral coordination sphere is completed by coordination of one N atom from a CN group of a neighbouring mol­ecule, leading to the final polymeric structure consisting of zigzag staggered chains in parallel orientation along the c-axis direction. Between the coord­in­ated water solvent molecule and the N atoms of uncoord­in­ated cyano-groups of neighboured units, two H-bridge bonds are formed. One of these H-bridge bonds is of inter- whereas the other of intra-strand nature, leading to a two-dimensional network parallel to (110) stabilizing the supramolecular structure. Six Zn—O or Zn—N bonds are found with lengths ranging from 2.061 (1) to 2.185 (1) Å and bond angles about the Zn atom are clustered in the ranges 79.83 (4)–104.21 (4) and 167.05 (4)–170.28 (4)°.
机译:淡黄色的标题配合物[Zn(C18H16N4O4)(H2O)] n在不对称单元中以一分子结晶。结构清楚地显示了N,N'-双-(2-氰基-乙基丙烯酰基)-1,2-二叠氮基苯配体稳定化的mer-η 4 O,O,N,N结合方式扭曲的八面体环境的Zn中心。在一个顶端位置的第五个配位点由配位溶剂水分子保持,而完整的八面体配位球是由相邻分子的CN基团中的一个N原子配位而完成的,最终形成由锯齿形交错链组成的最终聚合物结构沿c轴方向平行排列。在配位的水溶剂分子与相邻单元的未配位的氰基的N原子之间,形成两个H桥键。这些H桥键之一是链间性质的,而另一个是链内性质的,导致平行于(110)的二维网络稳定了超分子结构。发现六个Zn-O或Zn-N键的长度在2.061(1)至2.185(1)Å之间,并且围绕Zn原子的键角聚集在79.83(4)–104.21(4)和167.05(4 )–170.28(4)°。

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