KMn(citrate)(H2O) | 860812-77-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: KMn(citrate)(H2O)
• CAS: 860812-77-7
• 化学式: C₆H₅O₇*H₂O*K*Mn
• 分子量: 301.153
• InChiKey: WZUMVQDINPGFMR-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  -9.08
• 重原子数：
  16.0
• 可旋转键数：
  5.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  172.12
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  manganese (II) acetate tetrahydrate 、 tripotassium citrate monohydrate 、 一水柠檬酸 以 乙醇 、 水 为溶剂， 以76%的产率得到KMn(citrate)(H2O)
  参考文献：
  名称：

  Solvothermal synthesis and characterization of 2D to 3D metal-citrate coordination polymer linked by K+ ions: {K[Mn(C6H5O7)(H2O)]}n

  摘要：

  The coordination polymer {K[Mn(C6H5O7)(H2O)]}(n) (1) (C6H5O73- = citrate trianion) was synthesized by solvothermal reaction and characterized analytically, spectroscopically (IR, EPR, XPS), thermally and magnetically. In compound 1, each citrate served as the unique pentadentate ligand coordinating to three Mn(II) ions. The carboxylate-bridged di-manganese cores were interlocked by alpha- and beta-carboxylates of the citrate chains into 2D layers, which are then woven in [1 0 0] direction into a novel 3D network by the K+ linkers. (C) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2004.12.023