[Mn(N,N,N-tris(2-benzimidazolylmethyl)amine)(NO3)(CH3OH)](NO3) * H2O | 190431-51-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: [Mn(N,N,N-tris(2-benzimidazolylmethyl)amine)(NO3)(CH3OH)](NO3) * H2O
• CAS: 190431-51-7
• 化学式: C₂₅H₂₅MnN₈O₄*H₂O*NO₃
• 分子量: 636.483
• InChiKey: WXYZOIZZARNADC-UHFFFAOYSA-N

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：

  聚合甲醛 、 Mn(N,N,N-tris(2-benzimidazolylmethyl)amine)(Cl2) 、 silver nitrate 以 甲醇 、 水 为溶剂， 以70%的产率得到[Mn(N,N,N-tris(2-benzimidazolylmethyl)amine)(NO3)(CH3OH)](NO3) * H2O
  参考文献：
  名称：

  Manganese(II) complex of the ‘tripod’ ligand tris(2-benzimidazolylmethyl)amine. Seven-coordinate Mn(II) in the crystal structure

  摘要：

  Mn(II) coordination compounds with tripodal N,N,N-tris-(2-benzimidazolylmethyl)amine (TMBA) have been synthesized and spectrescopically characterized. The crystal structure of [Mn(TMBA)(NO3)(CH3OH)](NO3)H2O has been determined. The compound crystallizes in the monoclinic space group P2(1)/c with four formula units in a cell of dimensions a = 11.3825(2), b = 13.4338(2), c = 17.9548(3) Angstrom, beta = 100.026(1)degrees; final R = 0.0299, based on 4745 independent reflections. The structure indicates the complex ion has a heptacoordinate metal center with a coordination polyhedron best described as capped octahedron. The octahedron is defined by three nitrogen atoms from the benzimidazole moieties (N(1A),N(1C) and N(1B)), the oxygen atom of the methanol O(41), and two oxygen atoms from the coordinating nitrate group O(11) and O(12). The capping ligating atom is the bridging N(1) from the TMBA ligand with a longer Mn-N distance of 2.551(1) Angstrom.

  DOI：

  10.1016/s0020-1693(96)05483-7