摘要
按1∶1的摩尔比,在试管中将铜配合物KCuL的甲醇溶液和CaCl2的水溶液进行缓慢扩散反应得到了具有1D链状结构的异金属配位聚合物,其化学组成为{[(CuL)Ca(CuL)].CH3CH2OH.0.5CH3OH}n,(H3L=N-(2-{[(1E)-(5-氯-2-羟基苯基)亚甲基]胺基}乙基)-2-羟基苯甲酰胺).通过IR谱,元素分析的方法对其进行了表征,利用X射线单晶衍射方法对其晶体结构进行了测定,该晶体属三斜晶系,空间群Pī,晶胞参数a=1.22428(18)nm,b=1.30262(19)nm,c=1.427 1(2)nm,α=113.146(2)°,β=108.114(2)°,γ=97.384(2)°,V=1.9053(5)nm3,C33.5H29Cl2Cu2CaN4O7,Mr=860.725,Z=2,Dc=1.411 g/cm3,μ(MoK)α=1.435mm-1,F(000)=824,R=0.0793,wR=0.2010,(I>2σ(I)),9616个可观察衍射点,6544个独立衍射点.结构分析表明:该化合物是由四核环相互连接而成的具有链状结构的配位聚合物.
Heterometallic chain coordination polymer with the chemical formula { [(CuL) Ca(CuL)] · CH3CH2OH·0.5CH3OH}n has been synthesized by a slow diffusio, reaction of KCuL methanol solution and CaCl2 aqueous solution with a 1 : 1 mole ratio in test-tubes, and characterized by elemental analysis, and IR spectra, where H3L = N-(2-{ [(1E)-(5-chloro-2-hydroxyphenyl) methylene] amino} ethyl)-2-hydroxybenzamide). The crystal structures were determined by single-crystal X ray diffraction analyses. The complex erystalizes in triclinic, space group Piwith a=1.224 28(18)nm, b=1.302 62(19)nm, c=1.427 1(2)nm,a=113.146(2)°,β=108.114(2)°,7=97.384(2)°,V=1.9053(5) nm^3, C33.5H29Cl2Cu2CaN4O7, Mr=860.725, Z=2, Dc=1.411g/cm^3,μ(MoKa)=1.435mm^-1, F (000)=824, R:0.079 3, wR=0.2010, (1〉2σ(I)), 9 616 reflections collected with I〉2a(1), 6 544 independent reflections, the compound is a heterometallie coordination polymer with chain molecular structures formed by tetranuclear cycles.
出处
《河南大学学报(自然科学版)》
CAS
北大核心
2009年第5期475-479,共5页
Journal of Henan University:Natural Science
基金
河南省自然科学基金项目(092300410031)
河南省教育厅自然科学基金项目(2009A150005)
关键词
铜
钙
配位聚合物
晶体结构
copper
calcium
coordination polymer
crystal structure