[Ho(5-nitroisophthalic acid-2H)(1,10-phenanthroline)(NO3)(DMF)]n | 922733-68-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: [Ho(5-nitroisophthalic acid-2H)(1,10-phenanthroline)(NO3)(DMF)]n
• 英文别名: [Ho(5-nip)(phen)(NO3)(DMF)]n
• CAS: 922733-68-4
• 化学式: C₃H₇NO*C₈H₃NO₆*C₁₂H₈N₂*Ho*NO₃
• 分子量: 689.354
• InChiKey: MJXLYZZIAQVTCE-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  0.57
• 重原子数：
  39.0
• 可旋转键数：
  4.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  235.69
• 氢给体数：
  0.0
• 氢受体数：
  12.0

反应信息

• 作为反应物：
  描述：

  [Ho(5-nitroisophthalic acid-2H)(1,10-phenanthroline)(NO3)(DMF)]n 以 neat (no solvent) 为溶剂， 生成 holmium(III) oxide
  参考文献：
  名称：

  Syntheses, characterization and the liquid-phase formation enthalpy changes of two new one-dimensional ribbon-like lanthanide supermolecular polymers

  摘要：

  Two novel one-dimensional ribbon-like mixed-ligand supermolecular polymers, [Ln(5-nip)(phen)(NO3) (DMF)](n) (Ln = Pr (1) and Ho (2)), assembled into two-dimensional networks by strong pi-pi stacking interactions, have been synthesized by reactions of lanthanide (III) salts with 5-nitroisophatha acid (5-H(2)nip) and 1,10-phenanthroline (phen) in DMF solvent. They possessed high thermal stabilities and their liquid-phase formation enthalpy changes were determined in DMF solvent at 25.15 degrees C using an RD496-III type microcalorimeter, which were Delta H-r(m)o(1) = -9.21 kJ mol(-1), and Delta H-r(m)o (2) 11.02 kJ mol(-1), respectively. (C) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2006.03.021
• 作为产物：
  描述：

  1,10-菲罗啉 、 holmium(III) nitrate hexahydrate 、 5-硝基异酞酸 、 N,N-二甲基甲酰胺 以 N,N-二甲基甲酰胺 为溶剂， 以78%的产率得到[Ho(5-nitroisophthalic acid-2H)(1,10-phenanthroline)(NO3)(DMF)]n
  参考文献：
  名称：

  Syntheses, characterization and the liquid-phase formation enthalpy changes of two new one-dimensional ribbon-like lanthanide supermolecular polymers

  摘要：

  Two novel one-dimensional ribbon-like mixed-ligand supermolecular polymers, [Ln(5-nip)(phen)(NO3) (DMF)](n) (Ln = Pr (1) and Ho (2)), assembled into two-dimensional networks by strong pi-pi stacking interactions, have been synthesized by reactions of lanthanide (III) salts with 5-nitroisophatha acid (5-H(2)nip) and 1,10-phenanthroline (phen) in DMF solvent. They possessed high thermal stabilities and their liquid-phase formation enthalpy changes were determined in DMF solvent at 25.15 degrees C using an RD496-III type microcalorimeter, which were Delta H-r(m)o(1) = -9.21 kJ mol(-1), and Delta H-r(m)o (2) 11.02 kJ mol(-1), respectively. (C) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2006.03.021