含吡嗪甲酸配体的双核铬配合物的水热合成、晶体结构及荧光性质(英文)
Hydrothermal Synthesis, Crystal Structure and Luminescence of a Binuclear Chromium Complex with Pyrazinecarboxylate Ligand
作者单位
郭玉华 安阳工学院化学与环境工程学院安阳 455000 
郁有祝 安阳工学院化学与环境工程学院安阳 455000
聊城大学化学化工学院聊城 252059 
吕 垒 聊城大学化学化工学院聊城 252059 
王军月 安阳工学院化学与环境工程学院安阳 455000 
黄 勇 安阳工学院化学与环境工程学院安阳 455000 
李大成 聊城大学化学化工学院聊城 252059 
摘要: 通过水热法合成了1个双核铬配合物[Cr2(OH)2(2-pca)4]·3H2O(2-Hpca=2-吡嗪甲酸),并对其进行了X-射线单晶衍射、红外光谱、元素分析、荧光和热的表征及研究。该配合物属于单斜晶系,P21/c空间群。晶体学数据:a=1.566 35(15),b=0.847 70(6),c=1.974 60(18) nm,β=90.645 0(10)°,C20H20Cr2N8O13Mr=684.44,V=2.621 7(4) nm3Dc=1.734 g·cm-3F(000)=1 392,μ=0.913 cm-1,Z=4,最终R=0.044 7,wR=0.112 0用于3 251个可观测点。在晶体结构中,每个铬原子均为六配位,其中来自两分子2-吡嗪甲酸的2个氮原子、2个羧酸基氧原子和2个桥连羟基上的氧原子,呈现畸变的八面体几何构型。
关键词: 2-吡嗪甲酸  晶体结构  铬配合物
基金项目: 
Abstract: A binuclear chromium complex [Cr2(OH)2(2-pca)4]·3H2O (2-pca=pyrazine-2-carboxylate anion) was hydrothermally prepared and characterized by single crystal X-ray diffraction, FTIR spectra, elemental analysis, luminescence and thermal analysis. It crystallizes in the monoclinic system, space group P21/c, with a=1.566 35(15), b=0.847 70(6), c=1.974 60(18) nm, β=90.645 0(10)°, C20H20Cr2N8O13, Mr=684.44, V=2.621 7(4) nm3, Dc=1.734 g·cm-3, F(000)=1 392, μ=0.913 cm-1, Z=4, the final R=0.044 7 and wR=0.112 0 for 3 251 reflections with I>2σ(I). X-ray diffraction analysis reveals that each Cr(Ⅲ) center is octahedrally coordinated by two nitrogen atoms and two oxygen atoms from two pyrazine-2-carboxylate anion ligands, and another two oxygen atoms from two hydroxyl groups. The two Cr(Ⅲ) centers are bridged by two μ2-O of OH group. CCDC: 752196.
Keywords: pyrazine-2-carboxylic acid  crystal structure  chromium(Ⅲ) complex
 
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郭玉华,郁有祝,吕 垒,王军月,黄 勇,李大成.含吡嗪甲酸配体的双核铬配合物的水热合成、晶体结构及荧光性质(英文)[J].无机化学学报,2012,28(4):846-850.
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