| 546138-08-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• CAS: 546138-08-3
• 化学式: C₂N₃*C₁₂H₈N₂*NO₃*Pb
• 分子量: 515.456
• InChiKey: BRMNNWUIOPAJPL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.49
• 重原子数：
  24.0
• 可旋转键数：
  0.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  153.66
• 氢给体数：
  0.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  1,10-菲罗啉 、 lead(II) nitrate 、 sodium dicyanamide 以 乙醇 、 水 为溶剂， 以72%的产率得到
  参考文献：
  名称：

  Syntheses and structures of two one-dimensional double-stranded lead polymers of dicyanamide with unusual coordination mode

  摘要：

  The combined use of lead nitrate, sodium dicyanamide (Nadca) and 1,10-phenanthroline or 2,2-bipyridine has led to the preparation of two one-dimensional coordination polymers Pb(dca)(NO3)(1,10-phen) (1) and Pb(dca)(2)(2,2'-bipy)(H2O) (2). X-ray crystallography shows that both 1 and 2 have one-dimensional chains with dca in a novel 1, 1,5-mu(3)-coordination mode, which results in one-dimensional double-stranded chains. This coordination mode has not been observed in the reported complexes of dca, further indicating the versatility of dca in bonding to metal ions. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0277-5387(03)00030-5