Xu Xiao-Juan, Miao Jian-Yun, Wang Jun
Department of Chemistry, Yancheng Teachers' College, Yancheng 224002, People's Republic of China.
Acta Crystallogr C. 2013 Jun;69(Pt 6):620-3. doi: 10.1107/S0108270113013000. Epub 2013 May 18.
In the crystal structure of the title two-dimensional metal-organic polymeric complex, [Cd2Cl4(C8H14N2O4)(H2O)2]n, the asymmetric unit contains a crystallographically independent Cd(II) cation, two chloride ligands, an aqua ligand and half a 2,2'-(piperazine-1,4-diium-1,4-diyl)diacetate (H2PDA) ligand, the piperazine ring centroid of which is located on a crystallographic inversion centre. Each Cd(II) centre is six-coordinated in an octahedral environment by an O atom from an H2PDA ligand and an O atom from an aqua ligand in a trans disposition, and by four chloride ligands arranged in the plane perpendicular to the O-Cd-O axis. The complex forms a two-dimensional layer polymer containing [CdCl2]n chains, which are interconnected into an extensive three-dimensional hydrogen-bonded network by C-H···O, C-H···Cl and O-H···O hydrogen bonds.
在标题二维金属有机聚合物配合物[Cd2Cl4(C8H14N2O4)(H2O)2]n的晶体结构中,不对称单元包含一个晶体学独立的Cd(II)阳离子、两个氯配体、一个水配体和半个2,2'-(哌嗪-1,4-二鎓-1,4-二基)二乙酸酯(H2PDA)配体,其哌嗪环质心位于晶体学反演中心上。每个Cd(II)中心在八面体环境中通过来自H2PDA配体的一个O原子和来自水配体的一个O原子以反式排列进行六配位,并通过排列在垂直于O-Cd-O轴的平面中的四个氯配体进行六配位。该配合物形成包含[CdCl2]n链的二维层状聚合物,这些链通过C-H···O、C-H···Cl和O-H···O氢键相互连接成广泛的三维氢键网络。