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首页> 外文期刊>Acta Crystallographica Section E: Crystallographic Communications >An unprecedented binuclear cadmium di-thio-carbamate adduct: bis-[μ2-N-(2-hydroxy-eth-yl)-N-iso-propyl-carbamodi-thio-ato-κ3S:S,S′]bis-{[N-(2-hydroxy-eth-yl)-N-iso-propyl-carbamodi-thio-ato-κ2S,S′](3-{(1E)-[(E)-2-(pyridin-3-yl-methyl-idene)hydrazin-1-yl-idene]meth-yl}pyridine-κN)cadmium]} dihydrate
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An unprecedented binuclear cadmium di-thio-carbamate adduct: bis-[μ2-N-(2-hydroxy-eth-yl)-N-iso-propyl-carbamodi-thio-ato-κ3S:S,S′]bis-{[N-(2-hydroxy-eth-yl)-N-iso-propyl-carbamodi-thio-ato-κ2S,S′](3-{(1E)-[(E)-2-(pyridin-3-yl-methyl-idene)hydrazin-1-yl-idene]meth-yl}pyridine-κN)cadmium]} dihydrate

机译:前所未有的双核二硫代氨基甲酸镉加合物:双-[μ2-N-(2-羟基-乙基-基)-N-异丙基-氨基甲酸-硫代-ato-κ3S:S,S'] bis- { [N-(2-羟基-乙基)-N-异丙基氨基甲酰氨基-硫代-κ2S,S'](3-{(1E)-[(E)-2-(吡啶-3-甲基-亚甲基)肼-1-基]甲基-}吡啶-κN)镉]二水合物

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摘要

The asymmetric unit in the title binuclear compound, [Cd(C6H12NOS2)2(C12H10N4)]2·2H2O, comprises a CdII atom, two di-thio-carbamate (dtc) anions, a monodentate 3-pyridine-aldazine ligand and a lattice water mol-ecule. The binuclear mol-ecule is constructed by the application of inversion symmetry. One dtc ligand simultaneously chelates one cadmium atom and bridges the centrosymmetric mate, while the other dtc ligand is chelating only. This leads to a centrosymmetric [Cd(dtc)2]2 core to which are appended two 3-pyridine-aldazine ligands. The resulting NS5 donor set is based on an octa-hedron. The three-dimensional mol-ecular packing is sustained by hydroxyl-O—H(hydrox-yl) and water-O—H?O(hydrox-yl) hydrogen bonding, leading to supra-molecular layers parallel to (101) which are connected by water-O—H?N(pyrid-yl) hydrogen bonding; additional C—H?O, S π(chelate ring) inter-actions are also evident. The retention of the central [Cd(dtc)2]2 core upon adduct formation is unprecedented in the structural chemistry of the zinc-triad di-thio-carbamates.
机译:标题双核化合物[Cd(C6H12NOS2)2(C12H10N4)] 2·2H2O中的不对称单元包含一个CdII原子,两个二硫代氨基甲酸酯(dtc)阴离子,一个单齿3-吡啶-哒嗪配体和一个晶格水分子。双核分子是通过反演对称性构建的。一个dtc配体同时螯合一个镉原子并桥接中心对称伴侣,而另一个dtc配体仅螯合。这导致了一个中心对称的[Cd(dtc)2] 2核心,在该核心上附加了两个3-吡啶-哒嗪配体。生成的NS5供体集基于八面体。三维分子-分子堆积是通过羟基-OH(羟基)和水-OH-O(羟基)氢键维持的,从而导致平行于(101)的超分子层通过水-OH-N(吡啶基)氢键连接;另外的CHOH,Sπ(螯合环)相互作用也很明显。加合物形成后,中心[Cd(dtc)2] 2核的保留在三元组锌二硫代氨基甲酸酯锌的结构化学中是前所未有的。

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