[RuH(dppe)2(η1-PCMe)][CF3SO3] | 1141510-33-9

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机磺酸及其衍生物
• 英文名称: [RuH(dppe)2(η1-PCMe)][CF3SO3]
• CAS: 1141510-33-9
• 化学式: CF₃O₃S*C₅₄H₅₂P₅Ru
• 分子量: 1106.02
• InChiKey: KQOWVXZRSQTVHD-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  11.66
• 重原子数：
  68.0
• 可旋转键数：
  8.0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  57.2
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  tetrafluoroboric acid 、 [RuH(dppe)2(η1-PCMe)][CF3SO3] 以 乙醚 、 二氯甲烷 为溶剂， 以40%的产率得到[RuH(dppe)2(η1-PF2Et)][BF4]
  参考文献：
  名称：

  Synthesis, Characterization and Reactivity of a η ¹ ‐Methylphosphaalkyne Complex, [RuH(dppe) ₂ (η ¹ ‐P≡CMe)][CF ₃ SO ₃ ]

  摘要：

  AbstractThe synthesis of the first example of a complex in which methylphosphaalkyne solely η1‐coordinates a metal center, [RuH(dppe)2(η1‐P≡CMe)][CF3SO3] [dppe = 1,2‐bis(diphenylphosphanyl)ethane], is reported. Treatment of this compound with HBF4 (acting as a source of HF) has led to the reduction of the phosphaalkyne and the formation of a rare PF2Et complex, [RuH(dppe)2(η1‐PF2Et)][BF4]. Both complexes have been crystallographically characterized. (© Wiley‐VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2008)

  DOI：

  10.1002/ejic.200701330
• 作为产物：
  描述：

  [(ruthenium)(hydride)(bis(1,2-diphenylphosphinoethane)](trifluoromethanesulfonate) 、 1-phosphapropyne 以 乙醚 、 二氯甲烷 为溶剂， 以75%的产率得到[RuH(dppe)2(η1-PCMe)][CF3SO3]
  参考文献：
  名称：

  Synthesis, Characterization and Reactivity of a η ¹ ‐Methylphosphaalkyne Complex, [RuH(dppe) ₂ (η ¹ ‐P≡CMe)][CF ₃ SO ₃ ]

  摘要：

  AbstractThe synthesis of the first example of a complex in which methylphosphaalkyne solely η1‐coordinates a metal center, [RuH(dppe)2(η1‐P≡CMe)][CF3SO3] [dppe = 1,2‐bis(diphenylphosphanyl)ethane], is reported. Treatment of this compound with HBF4 (acting as a source of HF) has led to the reduction of the phosphaalkyne and the formation of a rare PF2Et complex, [RuH(dppe)2(η1‐PF2Et)][BF4]. Both complexes have been crystallographically characterized. (© Wiley‐VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2008)

  DOI：

  10.1002/ejic.200701330