[Co(azelate)(4,4'-dipyridylamine)(H2O)]n | 1174016-21-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: [Co(azelate)(4,4'-dipyridylamine)(H2O)]n
• CAS: 1174016-21-7
• 化学式: C₉H₁₄O₄*C₁₀H₉N₃*Co*H₂O
• 分子量: 434.418
• InChiKey: JJLWFLLNRAWDCB-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  0.61
• 重原子数：
  28.0
• 可旋转键数：
  10.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  149.57
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  [Co(azelate)(4,4'-dipyridylamine)(H2O)]n 以 neat (no solvent, solid phase) 为溶剂， 生成 cobalt(II) oxide 、 水
  参考文献：
  名称：

  Metal azelate coordination polymers containing a kinked dipyridyl tether: CdSO4 topology and “ligand vacancy” primitive cubic three-dimensional networks

  摘要：

  Hydrothermal self-assembly has generated three coordination polymers incorporating the kinked hydrogen-bonding capable tethering ligand 4,4'-dipyridylamine (dpa) and the long flexible aliphatic dicarboxylate azelate dianion (-O2C(CH2)(7)CO2-, aze), [M(aze)(dpa)(H2O)](n) (M = Co, 1; M = Ni, 2) and {[Cd(aze)(dpa)] center dot 2H(2)O}(n) (3). Complexes 1 and 2 possess crystallographically disordered azelate ligands, forming related three-dimensional (3-D) 4-connected "ligand vacancy" primitive cubic coordination polymer networks via the random intersection of two different types of [M(aze)(dpa)](n) idealized two-dimensional (2-D) layers. Compound 3 manifests a 3-D 6(5)8 CdSO4 topology coordination polymer network, formed from orthogonal sets of parallel [Cd(aze)](n) double chains linked through dpa ligands. Luminescent properties for 3 and thermal properties are also discussed. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2009.03.004
• 作为产物：
  描述：

  壬二酸 、 4,4,-二吡啶胺 、 cobalt(II) chloride hexahydrate 以 水 为溶剂， 以50%的产率得到[Co(azelate)(4,4'-dipyridylamine)(H2O)]n
  参考文献：
  名称：

  Metal azelate coordination polymers containing a kinked dipyridyl tether: CdSO4 topology and “ligand vacancy” primitive cubic three-dimensional networks

  摘要：

  Hydrothermal self-assembly has generated three coordination polymers incorporating the kinked hydrogen-bonding capable tethering ligand 4,4'-dipyridylamine (dpa) and the long flexible aliphatic dicarboxylate azelate dianion (-O2C(CH2)(7)CO2-, aze), [M(aze)(dpa)(H2O)](n) (M = Co, 1; M = Ni, 2) and {[Cd(aze)(dpa)] center dot 2H(2)O}(n) (3). Complexes 1 and 2 possess crystallographically disordered azelate ligands, forming related three-dimensional (3-D) 4-connected "ligand vacancy" primitive cubic coordination polymer networks via the random intersection of two different types of [M(aze)(dpa)](n) idealized two-dimensional (2-D) layers. Compound 3 manifests a 3-D 6(5)8 CdSO4 topology coordination polymer network, formed from orthogonal sets of parallel [Cd(aze)](n) double chains linked through dpa ligands. Luminescent properties for 3 and thermal properties are also discussed. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2009.03.004