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Synthesis, crystal structures, and theoretical calculations of two diverse three-dimensional hybrid materials based on polyoxoanions bridging macrocyclic copper/nickel complex
Inorganic and Nano-Metal Chemistry ( IF 1.4 ) Pub Date : 2020-09-09 , DOI: 10.1080/24701556.2020.1813171
Jin-Hui Xie 1 , Ying-Zhi Tan 1 , Zun-Hua Li 1 , Qiang Zhou 1 , Guang-Chuan Ou 1
Affiliation  

Abstract

Two hybrid materials, formulated as [NiL]3[VO3]6·2H2O (1) and [CuL][VO3]2·2H2O (2) (L = 1,8-dibutyl-1,3,6,8,10,13-hexaazacyclotetradecane), were obtained by the reactions of transition metal macrocyclic complexes [ML](ClO4)2 (M = Ni, Cu) with NH4VO3, characterized by elemental analysis, infrared spectroscopy analysis, thermogravimetric analysis, and X-ray powder diffraction. The single-crystal structures analysis showed that the Ni(II)/Cu(II) atom is coordinated by two oxygen atoms from [VO4] tetrahedra, plus four nitrogen atoms from L, forming a distorted six-coordinate octahedral coordination geometry. Six [VO4] tetrahedra form a hexanuclear [V6O18]6− ring by sharing six μ2-oxygen atoms in compound 1, and the [VO4] tetrahedra are connected by sharing μ2-oxygen atoms to form a one-dimensional zigzag chain of [VO3]nn- in compound 2. Compounds 1 and 2 show diverse three-dimensional structures, which are constructed by the connections of hexanuclear [V6O18]6- rings with [NiL]2+ moieties in compound 1, and [VO3]nn- chains with [CuL]2+ moieties in compound 2, respectively.



中文翻译:

基于多氧阴离子桥接大环铜/镍配合物的两种不同三维杂化材料的合成,晶体结构和理论计算

摘要

两种混合材料,分别表示为[NiL] 3 [VO 3 ] 6 ·2H 2 O(1)和[CuL] [VO 3 ] 2 ·2H 2 O(2)(L = 1,8-二丁基-1,3过渡金属大环配合物[ML](ClO 42(M = Ni,Cu)与NH 4 VO 3反应制得(,6,8,10,13-六氮杂环十四烷),并用元素分析,红外光谱法表征分析,热重分析和X射线粉末衍射。单晶结构分析表明Ni(II)/ Cu(II)原子由[VO 4]四面体,再加上L中的四个氮原子,形成扭曲的六坐标八面体配位几何。六[VO 4 ]四面体形成六核[V 6 ø 18 ] 6-通过共享六个环μ 2在化合物-氧原子1,并且[VO 4 ]四面体通过共享连接μ 2 -氧原子以形成一的维锯齿形链[VO 3 ] ñ ñ -在化合物2。化合物12显示多样的三维结构,其由六核的连接构造[V 6 ø 18 ] 6-环与[NIL] 2+部分在化合物1和[VO 3 ] ñ ñ -与[CUL]链2+分别在化合物2中的部分。

更新日期:2020-09-09
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