首页> 外文期刊>International Journal of Quantum Chemistry >Inorganic-organic hybrid materials: Synthesis and X-ray structure of N,N '-dimethylimidazolium salts [(Me(2)Im)(2)][Cd-2(SCN)(6)] and N,N '-dicyclohexylimidazolium [(Cy(2)Im)(2)][Cd-2(SCN)(6)] center dot C3H6O
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Inorganic-organic hybrid materials: Synthesis and X-ray structure of N,N '-dimethylimidazolium salts [(Me(2)Im)(2)][Cd-2(SCN)(6)] and N,N '-dicyclohexylimidazolium [(Cy(2)Im)(2)][Cd-2(SCN)(6)] center dot C3H6O

机译:无机-有机杂化材料:N,N'-二甲基咪唑鎓盐[(Me(2)Im)(2)] [Cd-2(SCN)(6)]和N,N'-二环己咪唑鎓盐的合成和X射线结构[(Cy(2)Im)(2)] [Cd-2(SCN)(6)]中心点C3H6O

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摘要

Two novel N,N'-dialkylimidazolium thiocyanate-cadmium complexes [(R2IM)(2)][Cd-2(SCN)(6)] for R = Me (3), and cyclohexyl (4) have been synthesized and characterized by single-crystal X-ray diffraction. Compound 3 crystallizes in the monoclinic unit cell dimensions of 17.468(3), 7.7273(12), 10.6750(16) Angstrom, 104.833(2)degrees, and space group C2 with two [(Me2IM)(2)] [Cd-2(SCN)(6)] per unit cell. The two cadmium atoms in 3 are octahedrally coordinated in 4N2S and 2N4S coordination environment, and linking into one-dimensional zigzag chains. Compound 4 belongs to the monoclinic space group Cc with unit cell of dimensions 13.3049(12), 17.5550(16), 20.8012(19) Angstrom, 101.494(2)degrees, and four [(Cy2IM)(2)][Cd-2(SCN)(6)] . C3H6O per unit cell. The cadmium atoms in 4 are all 3N3S hexa-coordinated with six bridging SCN- ions in an fac configuration and form infinite zigzag polymeric chains. The infinite chains in 3 form an approximate hexagonal array, making triangular channels which are occupied by N,N'-dimethylimidazolium ions, whereas the chains in 4 form layered structure, and the layers are stacked perpendicularly with respect to the orientation of the infinite anionic chains alternatively. N,N'-dicyclohexylimidazolium cations and solvent molecules fill in between layers. (C) 2002 Elsevier Science (USA). [References: 27]
机译:合成了两个新颖的N,N'-二烷基咪唑硫氰酸盐-镉络合物[(R2IM)(2)] [Cd-2(SCN)(6)],并合成了环己基(4),并进行了表征单晶X射线衍射。化合物3在单斜晶胞尺寸为17.468(3),7.7273(12),10.6750(16)埃,104.833(2)度和具有两个[[Me2IM)(2)] [Cd-2]的空间群C2中结晶(SCN)(6)]。 3中的两个镉原子在4N2S和2N4S配位环境中八面体配位,并链接成一维之字形链。化合物4属于单斜空间群Cc,其晶胞尺寸为13.3049(12),17.5550(16),20.8012(19)埃,101.494(2)度和四个[(Cy2IM)(2)] [Cd-2 (SCN)(6)]。每单位电池C3H6O。 4个中的镉原子都是3N3S六配位化合物,并以fac构型连接六个桥接SCN-离子,并形成无限的之字形聚合物链。 3中的无限链形成近似六边形阵列,形成被N,N'-二甲基咪唑鎓离子占据的三角形通道,而4中的链形成分层结构,并且各层相对于无限阴离子的方向垂直堆叠链交替。 N,N'-二环己基咪唑鎓阳离子和溶剂分子填充在层之间。 (C)2002 Elsevier Science(美国)。 [参考:27]

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