Carbon monoxide;chlororuthenium(1+);2,2-dimethylpropylidenephosphane;2-isocyano-1,3-dimethylbenzene;triphenylphosphane;tetrafluoroborate | 176635-92-0

• 英文名称: Carbon monoxide;chlororuthenium(1+);2,2-dimethylpropylidenephosphane;2-isocyano-1,3-dimethylbenzene;triphenylphosphane;tetrafluoroborate
• CAS: 176635-92-0
• 化学式: BF₄*C₅₁H₅₀ClNOP₃Ru
• 分子量: 1009.21
• InChiKey: ZXXIBIJSACRQOE-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  13.67
• 重原子数：
  63
• 可旋转键数：
  7
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  5.4
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  Carbon monoxide;chlororuthenium(1+);2,2-dimethylpropylidenephosphane;2-isocyano-1,3-dimethylbenzene;triphenylphosphane;tetrafluoroborate 、 四丁基氟化铵 以 not given 为溶剂， 生成
  参考文献：
  名称：

  Complete metal-mediated reduction of the triple bond of a phosphaalkyne: X-ray structure of [Ru(PHFCH₂Bu^t)Cl(CO)(CNC₆H₃Me₂-2,6)(PPh₃)₂]BF₄·CH₂Cl₂

  摘要：

  The reaction of [Ru(P=CHBu(t))Cl(CO)(CNC(6)H(3)Me(2)-2,6)(PPh(3))(2)] with HBF4 provides, rapidly and reversibly, the phosphaalkene complex [Ru(HP=CHBu(t))Cl(CO)(CNC(6)H(3)Me(2)-2,6)(PPh(3))(2)](+) which is converted by K[HF2] or [NBu(n)4]F to the structurally characterised fluorophosphine complex [Ru(PHFCH(2)Bu(t))Cl(CO)(CNC(6)H(3)Me(2)-2,6)(PPh(3))(2)](+).

  DOI：

  10.1039/cc9960001895
• 作为产物：
  描述：

  、 2,6-二甲基苯基异腈 以 二氯甲烷 为溶剂， 生成 Carbon monoxide;chlororuthenium(1+);2,2-dimethylpropylidenephosphane;2-isocyano-1,3-dimethylbenzene;triphenylphosphane;tetrafluoroborate
  参考文献：
  名称：

  Complete metal-mediated reduction of the triple bond of a phosphaalkyne: X-ray structure of [Ru(PHFCH₂Bu^t)Cl(CO)(CNC₆H₃Me₂-2,6)(PPh₃)₂]BF₄·CH₂Cl₂

  摘要：

  The reaction of [Ru(P=CHBu(t))Cl(CO)(CNC(6)H(3)Me(2)-2,6)(PPh(3))(2)] with HBF4 provides, rapidly and reversibly, the phosphaalkene complex [Ru(HP=CHBu(t))Cl(CO)(CNC(6)H(3)Me(2)-2,6)(PPh(3))(2)](+) which is converted by K[HF2] or [NBu(n)4]F to the structurally characterised fluorophosphine complex [Ru(PHFCH(2)Bu(t))Cl(CO)(CNC(6)H(3)Me(2)-2,6)(PPh(3))(2)](+).

  DOI：

  10.1039/cc9960001895