[Cu(2,2'-(1,1'-(ethylenedioxydinitrilo)diethylidyne)diphenolato)]*methanol | 1236788-84-3

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: [Cu(2,2'-(1,1'-(ethylenedioxydinitrilo)diethylidyne)diphenolato)]*methanol
• CAS: 1236788-84-3
• 化学式: CH₄O*C₁₈H₁₈CuN₂O₄
• 分子量: 421.94
• InChiKey: ZFRCUPRXMJTNPG-HPKCLRQXSA-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：

  [Cu(2,2'-(1,1'-(ethylenedioxydinitrilo)diethylidyne)diphenolato)]*methanol 以 neat (no solvent, solid phase) 为溶剂， 生成 copper(II) oxide
  参考文献：
  名称：

  Trinuclear and mononuclear copper(II) complexes incorporating tetradentate 2,2′-[1,1′-(ethylenedioxydinitrilo)diethylidyne]diphenol ligand: Syntheses, crystal structures, spectral and thermal behaviors

  摘要：

  Mononuclear and trinuclear Cu(II) complexes with chemical formula [CuL]center dot CH(3)OH (1) and [{(Cu(mu-L))(2)(OAc)(2)}Cu] (2), where H(2)L = 2,2'-[1,1'-(ethylenedioxydinitrilo)diethylidyne]diphenol, have been synthesized and characterized by elemental analyses, (1)H NMR, IR and UV-vis spectra et al. Crystallographic data of complex 1 reveal the formation of an asymmetric mononuclear structure and a slight distortion toward tetrahedral geometry from the square planar structure, in which the introduction of the non-coordinated methanol molecule lead to the assembly of the 1D chains by hydrogen bonding, Cu center dot center dot center dot pi and pi center dot center dot center dot pi interactions. Complex 2 have the elongated square pyramidal geometries for the two terminal Cu(II) ions and an octahedral coordinated geometry for the central Cu(II) ion. In complex 2, two acetate ions coordinate to three Cu(II) ions adopting a familiar syn-syn (mu M-O-C-O-M) coordinated fashion. The central Cu(II) ion sits in a crystallographic inversion centre. Therefore, the whole molecule of complex 2 is rigorously centrosymmetric, and forms a 3D supramolecular networks through intermolecular C-H center dot center dot center dot O and C-H center dot center dot center dot pi interactions. (C) 2010 Published by Elsevier B.V.

  DOI：

  10.1016/j.saa.2010.04.002
• 作为产物：
  描述：

  甲醇 、 2,2'-(1,1'-(ethylenedioxydinitrilo)diethylidyne)diphenol 、 copper(II) acetate monohydrate 以 甲醇 、 丙酮 为溶剂， 以23.1%的产率得到[Cu(2,2'-(1,1'-(ethylenedioxydinitrilo)diethylidyne)diphenolato)]*methanol
  参考文献：
  名称：

  Trinuclear and mononuclear copper(II) complexes incorporating tetradentate 2,2′-[1,1′-(ethylenedioxydinitrilo)diethylidyne]diphenol ligand: Syntheses, crystal structures, spectral and thermal behaviors

  摘要：

  Mononuclear and trinuclear Cu(II) complexes with chemical formula [CuL]center dot CH(3)OH (1) and [{(Cu(mu-L))(2)(OAc)(2)}Cu] (2), where H(2)L = 2,2'-[1,1'-(ethylenedioxydinitrilo)diethylidyne]diphenol, have been synthesized and characterized by elemental analyses, (1)H NMR, IR and UV-vis spectra et al. Crystallographic data of complex 1 reveal the formation of an asymmetric mononuclear structure and a slight distortion toward tetrahedral geometry from the square planar structure, in which the introduction of the non-coordinated methanol molecule lead to the assembly of the 1D chains by hydrogen bonding, Cu center dot center dot center dot pi and pi center dot center dot center dot pi interactions. Complex 2 have the elongated square pyramidal geometries for the two terminal Cu(II) ions and an octahedral coordinated geometry for the central Cu(II) ion. In complex 2, two acetate ions coordinate to three Cu(II) ions adopting a familiar syn-syn (mu M-O-C-O-M) coordinated fashion. The central Cu(II) ion sits in a crystallographic inversion centre. Therefore, the whole molecule of complex 2 is rigorously centrosymmetric, and forms a 3D supramolecular networks through intermolecular C-H center dot center dot center dot O and C-H center dot center dot center dot pi interactions. (C) 2010 Published by Elsevier B.V.

  DOI：

  10.1016/j.saa.2010.04.002