| 191021-07-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• CAS: 191021-07-5
• 化学式: C₁₆H₁₀Cl₆N₂O₅Zn
• 分子量: 588.374
• InChiKey: AIQFYDYFLRUZCK-UHFFFAOYSA-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

• 作为产物：
  描述：

  zinc (II) trichloroacetate 、 1,10-菲罗啉 以 乙醇 、 水 为溶剂， 生成
  参考文献：
  名称：

  Synthesis, characterization and structural studies of mono- and polynuclear complexes of zinc(II) with 1,10-phenanthroline, 2,2′-bipyridine and 4,4′-bipyridine

  摘要：

  Three complexes of the formula [Zn(2,2'-bipy)(CCl3CO2)(2)(H2O)] (1). [Zn (1,10-phen)(CCl3CO2)(2)(H2O)] (1a) and [Zn(mu-4,4'-bipy)(4,4-bipy)(2)(CCl3CO2)(2)(H2O)(4)](n) (2) have been synthesized and characterized by elemental analysis, IR spectra, thermal analysis and single-crystal X-ray diffraction for 1 and 2 and X-ray powder pattern for 1a. The metal coordination in complex 1 is distorted trigonal bipyramidal with N(1), O(2) and O(5) defining the basal plane, O(3) and N(2) being in apical positions. The X-ray crystal structure of 2 reveals that the local coordination round the Zn-II ion is a distorted octahedron, in which Zn(H2O)(4) coordination planes are bridged by 4,4'-bipyridine to form an infinite chain structure. Two 4,4'-bipyridine molecules and two trichloroacetate anions exist in the lattice linked by intermolecular hydrogen bonds to coordinated water molecule. Complexes 1 and 1a have a similar pattern of bonding and showed identical TGA curve and almost similar X-ray powder diffractograms. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0277-5387(96)00562-1