dichlorocopper;2,11,18,22-tetrazatetracyclo[21.4.0.04,9.012,17]heptacosa-1(27),4,6,8,12,14,16,23,25-nonaene-3,10-dione | 178434-22-5

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酰胺类
• 英文名称: dichlorocopper;2,11,18,22-tetrazatetracyclo[21.4.0.04,9.012,17]heptacosa-1(27),4,6,8,12,14,16,23,25-nonaene-3,10-dione
• CAS: 178434-22-5
• 化学式: C₂₃H₂₂Cl₂CuN₄O₂
• 分子量: 520.905
• InChiKey: YFQCXJBKIVBORD-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  32
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  82.3
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  copper(II) choride dihydrate 、 1,3-丙二胺 、 邻苯二甲酸 、 2-溴苯胺 以 乙醇 为溶剂， 以60%的产率得到dichlorocopper;2,11,18,22-tetrazatetracyclo[21.4.0.04,9.012,17]heptacosa-1(27),4,6,8,12,14,16,23,25-nonaene-3,10-dione
  参考文献：
  名称：

  Synthesis and Characterization of 14-to 16-Membered Tetraazamacrocyclic Transition Metal Complexes Bearing Diamide Groups

  摘要：

  (o) under bar-Bromoaniline, primary diamines and dicarboxylic acids in a 2:1:1 molar ratio in methanol react with metals to yield [MLCl(2)] complexes [M = Fe(II), Co(II), Ni(II), Cu(II) and Zn(II); L = L(1)-L(6)] and was characterized by physicochemical methods such as IR, H-1 NMR, EPR, UV/VIS, magnetic susceptibility, electrical conductivity and elemental analyses. All complexes are polycrystalline and are slightly soluble in DMF and MeCN and freely soluble in DMSO. All macrocyclic diamide complexes showed octahedral geometry and the electrical conductivity data agree well with the nonelectrolytic nature of the complexes.

  DOI：

  10.1080/00945719608004339