| 363594-09-6

• CAS: 363594-09-6
• 化学式: C₅₄H₄₀Cl₂FeN₄O₂*Cl
• 分子量: 939.143
• InChiKey: BOQDBNFPOPJCGN-UVGWPJPNSA-K

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：

  2,6-dibenzoyl-4-methylphenol 、 三氯化铁 、 邻苯二胺 以 乙醇 为溶剂， 生成
  参考文献：
  名称：

  Mononuclear iron(III)macrocyclic complexes derived from 4-methyl-2,6-di(formyl/benzoyl)phenol and diamines: synthesis, spectral speciation and electrochemical behaviour

  摘要：

  Two series of macrocyclic iron(III) complexes of stoichiometry [Fe(L)Cl-2]Cl (1, 2) have been synthesised and characterised. Compounds belonging to series 1 are derived from 4-methyl-2,6-diformylphenol and diamines (H2L), and those of 2 from 4-methyl-2,6-dibenzoylphenol and diamines. All the brown complexes have been characterised by physicochemical techniques. The mass, infrared, electronic, ESR and Mossbauer spectroscopies, magnetic susceptibility data, molar conductance, X-ray diffraction and cyclic voltammetric studies provide unambiguous evidence that 1 and 2 are high-spin iron(III) complexes in which the metal has an octahedral geometry. The Mossbauer data are consistent with high-spin iron(III) and substantial covalency in the Fe(III)-ligand bonds. Cyclic voltammetric studies in DMSO of the mononuclear iron(III) complexes show that they undergo quasi-reversible reduction with E-1/2 approximately -0.74 V versus SCE. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0277-5387(01)00786-0