trans-manganese(II) isonicotinate tetrahydrate | 259089-29-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: trans-manganese(II) isonicotinate tetrahydrate
• 英文别名: trans-tetraaquabis(isonicotinato)manganese(II)；[Mn(isonicotinate)2(H2O)4]；manganese(2+);pyridine-4-carboxylate;tetrahydrate
• CAS: 259089-29-7；32355-31-0
• 化学式: C₁₂H₁₆MnN₂O₈
• 分子量: 371.206
• InChiKey: WRBMCPFFMYDYBA-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  -4.41
• 重原子数：
  23
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  110
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  trans-manganese(II) isonicotinate tetrahydrate 以 neat (no solvent, solid phase) 为溶剂， 生成 Mn(INA)₂
  参考文献：
  名称：

  Chakrabortty, Monideepa; Ganguli, Jatindra Nath; Bora, Sanchay Jyoti, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 2010, vol. 49, # 7, p. 876 - 881

  摘要：

  DOI：
• 作为产物：
  描述：

  异烟酸 、 manganese(II) chloride tetrahydrate 、 水 在 CaCl₂ 、 NaOH 作用下， 以 水 为溶剂， 以40%的产率得到trans-manganese(II) isonicotinate tetrahydrate
  参考文献：
  名称：

  Supramolecular structures and fluorescence properties of three transition-metal complexes

  摘要：

  Three mononuclear transition-metal(II) compounds [Co(imidazole)(6)]CO(3)(.)5H(2)O (1), [Co(nicotinate)2(H2O)(4)] (2) and [Mn(isonicotinate)(2)(H2O)(4)] (3) ware obtained under the hydrothermal conditions. It deserves to note that they all exhibit interesting supramolecular topologies: in a crystal host of 1 three crystallographically unique free H2O molecules form a two-dimensional (2-D) water network based on the cyclic dodecamers with the occluded CO32- anions; both 2 and 3 possess 3-D network structures formed through the pi-pi stacking interactions of the pyridine rings and multi-types of O(...)Ow hydrogen-bonded interactions. All of these compounds show the strong fluorescence emissions with the peaks at 389, 650 and 390-420 nm (broad band) when excited at 220, 360 and 254 nm, respectively, which can be assigned to the charge transfer between the metal and the ligand. (c) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2006.02.042