triaqua(N-4-fluorophenylmethyliminodiacetato)nickel(II) monohydrate | 1341233-23-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: triaqua(N-4-fluorophenylmethyliminodiacetato)nickel(II) monohydrate
• CAS: 1341233-23-5
• 化学式: C₁₁H₁₆FNNiO₇*H₂O
• 分子量: 369.954
• InChiKey: AOILQULASKYRNE-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

• 作为反应物：
  描述：

  次黄嘌呤 、 triaqua(N-4-fluorophenylmethyliminodiacetato)nickel(II) monohydrate 以 水 为溶剂， 生成 diaqua(hypoxanthine)(N-4-fluorophenylmethyliminodiacetato)nickel(II) monohydrate
  参考文献：
  名称：

  Chelating Ligand Conformation Driving the Hypoxanthine Metal Binding Patterns

  摘要：

  The X-ray diffraction structural results of 23 ternary compounds, type M-II(iminodiacetate-like)(hypoxanthine) [M = Co, Ni, Cu, or Zn], show that the iminodiacetate moiety conformation (mer-NO2 or fac-NO2) is able to drive the M-hypoxanthine binding patterns displaying the M-N9 or M-N3 bond, cooperating with a N9-H center dot center dot center dot O intramolecular interaction, respectively.

  DOI：

  10.1021/ic201918y
• 作为产物：
  描述：

  (carboxymethyl(4-fluorobenzyl)amino)acetic acid 在 basic nickel carbonate 作用下， 以 not given 为溶剂， 生成 triaqua(N-4-fluorophenylmethyliminodiacetato)nickel(II) monohydrate
  参考文献：
  名称：

  Chelating Ligand Conformation Driving the Hypoxanthine Metal Binding Patterns

  摘要：

  The X-ray diffraction structural results of 23 ternary compounds, type M-II(iminodiacetate-like)(hypoxanthine) [M = Co, Ni, Cu, or Zn], show that the iminodiacetate moiety conformation (mer-NO2 or fac-NO2) is able to drive the M-hypoxanthine binding patterns displaying the M-N9 or M-N3 bond, cooperating with a N9-H center dot center dot center dot O intramolecular interaction, respectively.

  DOI：

  10.1021/ic201918y