[Ru(CO)(PPh3)(η4-S(C2H4SCCMe)2CO-κS)] | 648431-05-4

• 英文名称: [Ru(CO)(PPh3)(η4-S(C2H4SCCMe)2CO-κS)]
• CAS: 648431-05-4
• 化学式: C₃₀H₂₉O₂PRuS₃
• 分子量: 649.801
• InChiKey: LUNLQHVWTNEMTP-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：

  [Ru(CO)(PPh3)(η4-S(C2H4SCCMe)2CO-κS)] 、 1,2-双(二苯基膦)乙烷 以 甲苯 为溶剂， 以60%的产率得到[Ru(CO)(Ph2PC2H4PPh2)(η4-S(C2H4SCCMe)2CO)]
  参考文献：
  名称：

  Organometallic Macrocyclic Chemistry. 6.¹ Chelate-Assisted Macrocyclization of 4,7,10-Trithiatrideca-2,11-diyne

  摘要：

  The diyne 4,7,10-trithiatrideca-2,11-diyne (TTDD) reacts smoothly at room temperature with [Ru(CO)(2)(PPh3)(3)] to form [Ru(COYPPh3){eta(4)-S(C2H4SCCMe)(2)CO-kappaS}], a cyclopentadienone complex in which the unique sulfur atom is also coordinated to the metal but may be displaced by dppe to provide[Ru(CO)(dppe){eta(4)-S(C2H4SCCMe)(2)CO}]. In contrast, 2,8-decadiyne fails to cyclize even at elevated temperatures, implicating thioether coordination in the mechanism of TTDD macrocyclization.

  DOI：

  10.1021/om0305723
• 作为产物：
  描述：

  dicarbonylchlorohydridobis(triphenylphosphine)ruthenium(II) 、 4,7,10-trithiatrideca-2,11-diyne 在 1,8-diazabicyclo[5.4.0]undec-7-ene 作用下， 以 not given 为溶剂， 生成 [Ru(CO)(PPh3)(η4-S(C2H4SCCMe)2CO-κS)]
  参考文献：
  名称：

  Organometallic Macrocyclic Chemistry. 6.¹ Chelate-Assisted Macrocyclization of 4,7,10-Trithiatrideca-2,11-diyne

  摘要：

  The diyne 4,7,10-trithiatrideca-2,11-diyne (TTDD) reacts smoothly at room temperature with [Ru(CO)(2)(PPh3)(3)] to form [Ru(COYPPh3){eta(4)-S(C2H4SCCMe)(2)CO-kappaS}], a cyclopentadienone complex in which the unique sulfur atom is also coordinated to the metal but may be displaced by dppe to provide[Ru(CO)(dppe){eta(4)-S(C2H4SCCMe)(2)CO}]. In contrast, 2,8-decadiyne fails to cyclize even at elevated temperatures, implicating thioether coordination in the mechanism of TTDD macrocyclization.

  DOI：

  10.1021/om0305723