首页> 外文期刊>Inorganica Chimica Acta >DESIGN, SYNTHESIS, STRUCTURAL AND THERMAL CHARACTERISATION OF POLYMERIC CHLOROCADMATE(II) COMPOUNDS WITH ONE-DIMENSIONAL INORGANIC CHAIN STRUCTURES
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DESIGN, SYNTHESIS, STRUCTURAL AND THERMAL CHARACTERISATION OF POLYMERIC CHLOROCADMATE(II) COMPOUNDS WITH ONE-DIMENSIONAL INORGANIC CHAIN STRUCTURES

机译:一维无机链结构的聚合氯代碳酸(II)化合物的设计,合成,结构和热表征

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The chlorocadmate(II) compounds of formula (Hmepd) [CdCl3] (1) (Hmepd=1-methylpiperidine cation), (H(2)meen)(2)[Cd2Cl8]. H2O (2) (H(2)meen=N-methylethylenediamine dication) and (H(2)amepz) [Cd2Cl6(H2O)(2)] (3) (H(2)amepz=1-amino-4-methylpiperazine dication) are synthesised and their structural and thermal properties investigated. Compound 1 crystallises in space group P2(l)/a. The unit cell dimensions are a=15.046(2), b=10.408(2) and c=6.786(3) Angstrom, beta=92.39(2)degrees, Z=4. The final R value is 0.0353 (Rw=0.0328). Its structure consists of one-dimensional polymeric chains of face sharing CdCl6 octahedra running along the c axis and methylpiperidinium cations. Compound 2 crystallises in the C2/c space group. The unit cell dimensions are a=18.459(2), b=6.986(3) and c=18.167(2) Angstrom, beta=115.95(2)degrees, Z=4. The final R value is 0.0296 (Rw=0.0330). Its crystal structure consists of polymeric chains of [CdCl4](2-) anions running along the b axis, organic cations and non-coordinated water molecules. Compound 3 crystallises in the P2(1)/a space group, with a=7.542(2), b=14.658(4) and c=8.052(2) Angstrom, beta=106.91(3)degrees, Z=2. The final R value is 0.0330 (Rw=0.0340). The crystal structure consists of organic cations and polymeric chains of edge-sharing CdCl5 (H2O) octahedra. In compounds 1 and 2 hydrogen bond interactions between the inorganic chains, the organic cations and the water molecules, if present, contribute to the crystal packing, while in compound 3 this contribution comes from the contacts less than 3.5 Angstrom. The thermal characterisation is also discussed. The structures are compared with other examples of chlorocadmate(II) compounds. [References: 29]
机译:式(Hmepd)[CdCl3](1)(Hmepd = 1-甲基哌啶阳离子),(H(2)meen)(2)[Cd2Cl8]的氯代甲酸酯(II)化合物。 H2O(2)(H(2)meen = N-甲基乙二胺二甲酸酯)和(H(2)amepz)[Cd2Cl6(H2O)(2)](3)(H(2)amepz = 1-氨基-4-甲基哌嗪合成),并研究其结构和热性能。化合物1在空间群P2(1)/ a中结晶。晶胞尺寸为a = 15.046(2),b = 10.408(2)和c = 6.786(3)埃,beta = 92.39(2)度,Z = 4。最终的R值为0.0353(Rw = 0.0328)。它的结构由沿c轴分布的共享CdCl6八面体的一维聚合物链和甲基哌啶鎓阳离子组成。化合物2在C2 / c空间基团中结晶。晶胞尺寸为a = 18.459(2),b = 6.986(3)和c = 18.167(2)埃,beta = 115.95(2)度,Z = 4。最终的R值为0.0296(Rw = 0.0330)。它的晶体结构由沿b轴延伸的[CdCl4](2-)阴离子,有机阳离子和非配位水分子的聚合物链组成。化合物3在P2(1)/ a空间组中结晶,a = 7.542(2),b = 14.658(4)和c = 8.052(2)埃,beta = 106.91(3)度,Z = 2。最终的R值为0.0330(Rw = 0.0340)。晶体结构由边缘共享的CdCl5(H2O)八面体的有机阳离子和聚合物链组成。在化合物1和2中,无机链,有机阳离子和水分子之间的氢键相互作用(如果存在)有助于晶体堆积,而在化合物3中,该贡献来自小于3.5埃的接触。还讨论了热特性。将结构与氯代碳酸二(II)化合物的其他实例进行比较。 [参考:29]

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