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Synthesis and crystal Structure of Aqua(diaminobithiazole (iminodiacetato)nickel(II) hydrate

机译:水合二氨基Bithiazole(亚氨基二乙酰基)水合镍(II)的合成和晶体结构

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摘要

(Crystals of the title compound, [(C_6H_6N_4S_2)(C_4H_5NO_4)(H_2O)Ni]-H_2O, consist of the Ni(II) complex and lattice water. The Ni(II) complex adopts a distorted octahedral coordination geometry formed by an iminodiacetate anion (IDA), a diaminobithiazole (DABT) and a coordinated water molecule. A twisted configuration of DABT is the distinguishing feature in the complex, the dihedral angle between thiazole rings of DABT being 20.04(8) deg. An aromatic stacking interaction occurs between thiazole rings from neighboring complex molecules, and is considered as the reason for the twisted configuration. The tridentate IDA dianion chelates to a Ni(II) atom in a facial configuration. A hydrogen bond network holds the complex molecules together to form a supramolecular structure.
机译:(标题化合物[(C_6H_6N_4S_2)(C_4H_5NO_4)(H_2O)Ni] -H_2O的晶体,由Ni(II)配合物和晶格水组成。Ni(II)配合物采用亚氨基二乙酸酯形成的扭曲的八面体配位几何形状阴离子(IDA),二氨基联苯二唑(DABT)和配位的水分子。DABT的扭曲构型是复合物中的显着特征,DABT的噻唑环之间的二面角为20.04(8)度。噻唑环由相邻的复合分子环形成,被认为是扭曲构型的原因;三齿IDA二价阴离子螯合到面部构型中的Ni(II)原子;氢键网络将复合分子结合在一起,形成超分子结构。

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