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化学学报
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化学学报 ›› 2004, Vol. 62 ›› Issue (5): 498-501. 上一篇    下一篇

研究论文

N,N,N′,N′-四(2-苯并咪唑亚甲基)-1,2-乙二胺的晶体和电子结构

孙云1, 霍建中1, 陈克2, 孙命1, 宋海斌3, 刘小兰1   

  1. 1. 天津师范大学化学与生命科学学院, 天津, 300074;
    2. 天津市医药职工大学, 天津, 300142;
    3. 南开大学化学学院, 天津, 300071
  • 投稿日期:2003-07-15 修回日期:2003-11-07 发布日期:2014-02-18
  • 通讯作者: 刘小兰,E-mail:liuxiaolan@eyou.com E-mail:liuxiaolan@eyou.com
  • 基金资助:
    天津市教委自然科学基金(No.97202)资助项目.

Crystal and Electronic Structure of N,N,N′,N′-Tetrakis-[(2-benzimidazolyl)methyl]-1,2-ethanediamine

SUN Yun1, HUO Jian-Zhong1, CHEN Ke2, SUN Ming1, SONG Hai-Bin3, LIU Xiao-Lan1   

  1. 1. College of Chemistry and Life Science, Tianjin Normal University, Tianjin 300074;
    2. Tianjin Adult Pharmaceutical College, Tianjin 300142;
    3. College of Chemistry, Nankai University, Tianjin 300071
  • Received:2003-07-15 Revised:2003-11-07 Published:2014-02-18

PDF

282

被引次数

18

合成了六齿配体N,N,N′,N′-四(2-苯并咪唑亚甲基)-1,2-乙二胺(EDTB).对该配体进行了元素分析、紫外和红外表征;采用X射线衍射方法测定了晶体结构,依据晶体结构数据使用G98程序对配体进行了量子化学计算.

关键词: 合成, 晶体结构, 电子结构, 量子化学计算, N,N,N’,N’-四(2-苯并咪唑亚甲基)-1,2-乙二胺(EDTB)

The hexadentate ligand N,N,N′,N′-tetrakis-[(2-benzimidazolyl)methyl]-1,2-ethanediamine (EDTB) was synthesized and characterized by elemental analysis, UV and IR spectra. The crystal structure of EDTB was determined by X-ray diffraction analysis and its quantum chemical calculation was performed by G98 program.

Key words: synthesis, crystal structure, electronic structure, quantum chemical calculation, N,N,N’,N’-tetrakis[(2-benzimidazolyl)methyl]-1, 2-ethanediamine(EDTB)