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Synthesis,Characterization and X-ray Crystal Structure of N,N'-Bis(4-nitrophenylcarba-mothioyl)-isophthalamide·DMF
作者姓名:WANG  Hai-Qin CHEN  Le PENG  Hao HE  Hong-Wu
作者单位:Key Laboratory of Pesticide and Chemical Biology, Ministry of Education and College of Chemistry, Central China Normal University, Wuhan 430079, China
基金项目:the National Basic Research Program of China,the National Natural Science Foundation of China,partly supported by the PCSIRT
摘    要:A new crystal of N,N'-bis(4-nitrophenylcarbamothioyl)isophthalamide DMF solva-te has been prepared at room temperature and characterized by elemental analysis and IR,MS,1H NMR spectra and X-ray single-crystal determination.The complex crystallizes in monoclinic,space group P21/c with a = 11.2093(12),b = 22.081(2),c = 13.9640(15) ,β= 112.128(2)°,V = 3201.8(6) 3,C28H30N8O8S2,Mr = 670.72,Dc = 1.391 Mg/m3,Z = 4,μ= 0.228 mm-1,F(000) = 1400,the final R = 0.0483 and wR = 0.1411(I > 2σ(I)).The molecular packing in the crystal is the result of N-H…O hydrogen bonding.

关 键 词:X射线晶体结构  二甲基甲酰胺  合成  表征  核磁共振光谱  元素分析  红外光谱  单斜晶系
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