[κ3-N,N',S-[4,5-(P(Se)Ph2)2(μ-tz)]InMe2]2 | 902492-06-2

• 英文名称: [κ3-N,N',S-[4,5-(P(Se)Ph2)2(μ-tz)]InMe2]2
• CAS: 902492-06-2
• 化学式: C₅₆H₅₂In₂N₆P₄Se₄
• 分子量: 1478.44
• InChiKey: AGGIONDWKZBDLJ-UHFFFAOYSA-N

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：

  四氢呋喃 、 [κ3-N,N',S-[4,5-(P(Se)Ph2)2(μ-tz)]InMe2]2 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Unusual In₂N₄ Cores in Complexes Containing Triazole-Based Chalcogen−Phosphoranyl Ligands

  摘要：

  The 4,5-bis(diphenylphosphoranyl)-1,2,3-triazole[4,5-(P(E)Ph-2)(2)tz] derivatives of indium {kappa(3)-N,N',E-[4,5-(P(E)Ph-2)(2)-(mu-tz)]InMe2}(2) (E) O(2), S(3), Se(4) were prepared in good yield. In addition, compound 5 (E = O, E' = Se) was obtained from 4 through the replacement of a selenium atom in the P-Se(In) moiety by an oxygen atom, giving the mixed-chalcogen complex. The crystal structures of 2 and 5 exhibit a central C4In2N6O2P4 core with an almost planar arrangement (mean deviation = 0.019 and 0.042 angstrom for 2 and 0.100 angstrom for 5), while the C4In2N6S2P4 core in 3 is nonplanar (mean deviation = 0.223 angstrom).

  DOI：

  10.1021/ic051567p
• 作为产物：
  描述：

  三甲基铟 、 4,5-(P(Se)Ph2)2tzH 以 正己烷 、 甲苯 为溶剂， 以68%的产率得到[κ3-N,N',S-[4,5-(P(Se)Ph2)2(μ-tz)]InMe2]2
  参考文献：
  名称：

  Unusual In₂N₄ Cores in Complexes Containing Triazole-Based Chalcogen−Phosphoranyl Ligands

  摘要：

  The 4,5-bis(diphenylphosphoranyl)-1,2,3-triazole[4,5-(P(E)Ph-2)(2)tz] derivatives of indium {kappa(3)-N,N',E-[4,5-(P(E)Ph-2)(2)-(mu-tz)]InMe2}(2) (E) O(2), S(3), Se(4) were prepared in good yield. In addition, compound 5 (E = O, E' = Se) was obtained from 4 through the replacement of a selenium atom in the P-Se(In) moiety by an oxygen atom, giving the mixed-chalcogen complex. The crystal structures of 2 and 5 exhibit a central C4In2N6O2P4 core with an almost planar arrangement (mean deviation = 0.019 and 0.042 angstrom for 2 and 0.100 angstrom for 5), while the C4In2N6S2P4 core in 3 is nonplanar (mean deviation = 0.223 angstrom).

  DOI：

  10.1021/ic051567p