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2,3-二苯基-1,4,6-三氮杂二环[3.3.1]-2-壬烯单盐酸盐的合成及晶体结构
引用本文:王虎林,薛岗林,徐媛,王兰英,王文亮,胡怀民.2,3-二苯基-1,4,6-三氮杂二环[3.3.1]-2-壬烯单盐酸盐的合成及晶体结构[J].有机化学,2003,23(7):710-713.
作者姓名:王虎林  薛岗林  徐媛  王兰英  王文亮  胡怀民
作者单位:1. 西北大学化学系陕西省物理无机化学重点实验室,西安,710069
2. 陕西师范大学化学系,西安,710058
3. 中国科学院化学研究所,北京,100080
基金项目:陕西省化学反应工程重点实验室开放基金,陕西省教委专项基金(No.99JK105)
摘    要:在ZrOCl_2的存在下,二乙烯三氨与联苯甲酰在甲醇中回流得到2,3-二苯基 -1,4,6-三氮杂二环3.3.1]-2-壬烯单盐酸盐。对其进行了~1H NMR,IR和 UV-vis谱表征及X射线单晶衍射结构分析。晶体属单斜晶系,P2_1/c空间群,晶胞 参数为:a=1.69341(6)nm,b=0.77564(3)nm,c=1.21000(4)nm,β=96.1880(10)° ,Z=4,D_c=1.319g·cm~(-3)。该化合物是一非平面型具有部分不饱和键的氮杂桥 二环化合物,两个六元环中,与苯环连接的六元环为半椅式构型,另一六元环为椅 式构型。

关 键 词:氮杂环化合物  壬烯  P  晶体结构  质子磁共振谱法  红外分光光度法  紫外分光光度法  X射线衍射分析
修稿时间:2002年7月19日

Synthesis and Crystal Structure of 2,3-Dibenzo-1,4,6-triazabicyclo [3.3.1]-2-nonenemonomuriate
WANG,Hu-Lin XUE,Gang-Lin XU,Yuan WANG,Lan-Ying WANG,Wen-Liang HU,Huai-Min.Synthesis and Crystal Structure of 2,3-Dibenzo-1,4,6-triazabicyclo [3.3.1]-2-nonenemonomuriate[J].Chinese Journal of Organic Chemistry,2003,23(7):710-713.
Authors:WANG  Hu-Lin XUE  Gang-Lin XU  Yuan WANG  Lan-Ying WANG  Wen-Liang HU  Huai-Min
Institution:Shaanxi Key Laboratory of Physico-Inorganic Chemistry, Department of Chemistry, Northwest University;Department of Chemistry, Shaanxi Normal University;Institute of Chemistry, Chinese Academy of Sciences
Abstract:The azo-cycle compound, 2,3-dibenzo-l, 4,6-triazabicyclo 3.3.1 ] - 2-nonenemonomuriate, was prepared by condensation of benzil with dienthyltriamine in methanol and in the presence of Z1OCI2, and was characterized by !H NMR, IR and UV-vis spectra. Its crystal structure was determined by X-ray diffraction analysis. The crystal belongs to monoclinic system, space group P2j/c, cell parameters: a = 1.69341(6) nm, b = 0.77564(3) nm, c = 1.21000(4) nm, /? = 96.1880(10)°, Z = 4, Dc = 1.319 g- cm"3. The compound is a non-planar aza-bicyclo compound with partial unsaturated bonds. The parent hexatomic ring is a chair conformation and the other six-member ring is a half-chair form.
Keywords:2  3-dibenzo-1  4  6-triazabicyclo[3  3  1]-2-nonenemonomuriate  synthesis  crystal structure
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