| 1289636-21-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• CAS: 1289636-21-0
• 化学式: C₂₂H₂₄Cu₂I₂N₄
• 分子量: 725.36
• InChiKey: YFXXGNQNCKNPIP-CRDIOSDUSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  、 potassium thioacyanate 以 二氯甲烷 、 乙腈 为溶剂， 生成
  参考文献：
  名称：

  Synthesis, characterization and crystal structures of di-three-coordinated copper(I) macrocyclic Schiff base complexes

  摘要：

  The air-stable di-copper(I) complexes Cu2L(SCN)(2) (1) and Cu2L(SCN)(1.86)I-0.14 (2) of the N-4 macrocyclic Schiff base ligand L have been synthesized and characterized by IR, elemental analysis, UV-Vis and crystal structure determination. X-ray analysis of the complexes shows an approximate distorted trigonal planar geometry around each copper(I) ion that is constructed from one N-bonded thiocyanate (or iodide in 2) group and two imine nitrogen atoms. DFT calculations were used to determine the structural features of the Cu2L(SCN)(2) complex, and these were consistent with the experimental data for the complex. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2010.12.041
• 作为产物：
  描述：

  copper(l) iodide 、 间苯二甲醛 、 1,3-丙二胺 以 乙腈 为溶剂， 以30%的产率得到
  参考文献：
  名称：

  Synthesis, characterization and crystal structures of dinuclear macrocyclic Schiff base copper(I) complexes bearing different bridges

  摘要：

  Utilizing a new 20-membered macrocyclic Schiff base ligand with two coordination sites formed from the [2+2] condensation of 1 3-diaminopropane and benzene-1 3-chcarboxaldehyde in the presence of CuX (X = Cl- Br- I-) salts air-stable dicopper(I) complexes were synthesized in acetonitrile intramolecularly linked via two halide groups and characterized by different physico chemical techniques The single crystal X-ray diffraction technique indicates these complexes consist of two N2X2 donor sets that have distorted tetrahedral coordination environments around the copper(I) ions In these halogen-bridged binuclear Cu2LX2 systems the Cu Cu separation can be controlled as this distance is reduced on increasing the halide size and hence the X X repulsion with the rigidity of the macrocycle playing a significant role (C) 2010 Elsevier Ltd All rights reserved

  DOI：

  10.1016/j.poly.2010.08.031