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首页> 外文期刊>Journal of chemical crystallography >Syntheses and crystal structures of two new cadmium(II) and nickel(II) complexes with 1,4-phenylenediacetate and 2,2′-bipyridyl-like ligands
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Syntheses and crystal structures of two new cadmium(II) and nickel(II) complexes with 1,4-phenylenediacetate and 2,2′-bipyridyl-like ligands

机译:两种新的具有1,4-苯二乙酸酯和2,2'-联吡啶基配体的新型镉(II)和镍(II)配合物的合成和晶体结构

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Two new complexes, namely [Cd(PDA)_(0.5)(2,2′-bpy)Cl](H _2PDA) (1) and [Ni(PDA)(phen)(H_2O)]_2 (2) (H 2PDA = 1,4-phenylenediacetic acid, 2,2′-bpy = 2,2′-bipyridine, phen = 1,10-phenanthroline), have been synthesized and characterized by elemental analysis, IR spectra and X-ray crystal diffraction. Single-crystal X-ray diffraction analysis shows that complex 1 crystallizes in the triclinic space group P-1 with unit cell dimensions a = 8.760 (4) ?, b = 11.190 (5) ?, c = 13.917 (7) ?, α = 110.383 (5)°, β = 101.736 (5)°, γ = 100.612 (5)°, V = 1202.8 (10) ?3, Z = 2, R 1 = 0.0314 and wR 2 = 0.0898. Complex 2 crystallizes in the monoclinic space group P2(1) with unit cell dimensions a = 9.911 (3) ?, b = 17.924 (6) ?, c = 10.638 (4) ?, β = 94.998 (5)°, V = 1882.7 (11) ?3, Z = 2, R 1 = 0.0397 and wR 2 = 0.1150. In complex 1, Cd(II) ions are alternately bridged by PDA ligands and chloride ions into 1D chains and the PDA ligands display trans-configuration. Complex 2 is a dimer and two Ni(II) ions are linked by two PDA ligands with cis-configuration, resulting in a cyclic structure. In spite of these differences, both in complexes 1 and 2 there are π-π stacking interactions and hydrogen bonding to make them 3D supramolecular frameworks. Graphical Abstract: Two new complexes [Cd(PDA) 0.5(2,2′-bpy)Cl](H2PDA) and [Ni(PDA)(phen)(H 2O)]2 (H2PDA = 1,4-phenylenediacetic acid, phen = 1,10-phenanthroline, 2,2′-bpy = 2,2′-bipyridine) were obtained and their structures were determined by single crystal X-ray diffraction. In complex [Cd(PDA)_(0.5)(2,2′-bpy)Cl](H2PDA), Cd(II) ions are alternately bridged by PDA ligands and chloride ions into 1D chains and the PDA ligands display trans-configuration. The complex [Ni(PDA)(phen)(H _2O)]_2 is the first nickel(II) complex constructed by H2PDA. And two Ni(II) ions in one unit are linked by two PDA ligands with cis-configuration, resulting in a cyclic structure.
机译:两个新的络合物,即[Cd(PDA)_(0.5)(2,2'-bpy)Cl](H _2PDA)(1)和[Ni(PDA)(phen)(H_2O)] _ 2(2)(H合成了2PDA = 1,4-苯二乙酸,2,2'-bpy = 2,2'-联吡啶,phen = 1,10-菲咯啉),并通过元素分析,IR光谱和X射线晶体衍射对其进行了表征。 X射线单晶衍射分析表明,配合物1在三斜晶系空间群P-1中结晶,晶胞尺寸为a = 8.760(4),b = 11.190(5),c = 13.917(7),α = 110.383(5)°,β= 101.736(5)°,γ= 100.612(5)°,V = 1202.8(10)θ3,Z = 2,R 1 = 0.0314,wR 2 = 0.0898。配合物2在单斜晶空间群P2(1)/ n中结晶,其晶胞尺寸为a = 9.911(3),b = 17.924(6),c = 10.638(4),β= 94.998(5)°, V = 1882.7(11)·3,Z = 2,R 1 = 0.0397,wR 2 = 0.1150。在配合物1中,Cd(II)离子被PDA配体和氯离子交替桥接成一维链,并且PDA配体显示出反式构型。络合物2是二聚体,两个Ni(II)离子通过两个具有顺式构型的PDA配体连接,形成环状结构。尽管存在这些差异,但在配合物1和2中都存在π-π堆积相互作用和氢键,使它们成为3D超分子骨架。图形摘要:两个新的络合物[Cd(PDA)0.5(2,2'-bpy)Cl](H2PDA)和[Ni(PDA)(phen)(H 2O)] 2(H2PDA = 1,4-苯二乙酸,获得了phen = 1,10-菲咯啉,2,2'-bpy = 2,2'-联吡啶,并通过单晶X射线衍射确定了它们的结构。在复杂的[Cd(PDA)_(0.5)(2,2'-bpy)Cl](H2PDA)中,Cd(II)离子被PDA配体和氯离子交替桥接成一维链,并且PDA配体显示反式构型。配合物[Ni(PDA)(phen)(H _2O)] _ 2是由H2PDA构建的第一个镍(II)配合物。一个单元中的两个Ni(II)离子通过两个具有顺式构型的PDA配体连接,形成环状结构。

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