| 182682-80-0

• CAS: 182682-80-0
• 化学式: C₃₈H₆₆O₂P₂Ru
• 分子量: 717.958
• InChiKey: UEKKDWCZDCLKHC-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：

  、 二苯基乙炔 以 甲苯 为溶剂， 以73%的产率得到Ru(η(2)-PhCCPh)(CO)2(PCy3)2
  参考文献：
  名称：

  Estimating the Effective Steric Impact of P^tBu₂Me, PⁱPr₃, and PCy₃

  摘要：

  Enthalpies of reaction of Ru(CO)(2)L(2) (L = (PPr3)-Pr-i, P(t)Bu(2)Me, and PCy(3)) with MeNC, PhC=CPh (both addition reactions) and PhCC-H (C-H oxidative addition) in toluene ape exothermic in the range 10-25 kcal/mol and are interpreted in terms of P(t)Bu(2)Me being more bulky than (PPr3)-Pr-i or PCy(3). Enthalpy comparisons show that the larger cone angle of PCy(3) than of (PPr3)-Pr-i can be overcome by the greater donor power of PCy(3); the origin of the greater donor power of PCy(3) is discussed.

  DOI：

  10.1021/om960380q
• 作为产物：
  描述：

  cis,trans,cis-[RuCl₂(PCy₃)₂(CO)₂] 在 1 percent sodium amalgam 作用下， 以 四氢呋喃 为溶剂， 以71%的产率得到
  参考文献：
  名称：

  Estimating the Effective Steric Impact of P^tBu₂Me, PⁱPr₃, and PCy₃

  摘要：

  Enthalpies of reaction of Ru(CO)(2)L(2) (L = (PPr3)-Pr-i, P(t)Bu(2)Me, and PCy(3)) with MeNC, PhC=CPh (both addition reactions) and PhCC-H (C-H oxidative addition) in toluene ape exothermic in the range 10-25 kcal/mol and are interpreted in terms of P(t)Bu(2)Me being more bulky than (PPr3)-Pr-i or PCy(3). Enthalpy comparisons show that the larger cone angle of PCy(3) than of (PPr3)-Pr-i can be overcome by the greater donor power of PCy(3); the origin of the greater donor power of PCy(3) is discussed.

  DOI：

  10.1021/om960380q

文献信息

• Ligand (L) Influence on CO Binding Enthalpies to Ru(CO)₂L₂
  作者：Chunbang Li、Montserrat Oliván、Steven P. Nolan、Kenneth G. Caulton

  DOI：10.1021/om970220u

  日期：1997.9.1

  Reaction enthalpies for the addition of CO to Ru(CO)(2)L-2 (L = (PBu2Me)-Bu-t, (PPr3)-Pr-i, and PCy3) in toluene are -26.2(3), -31.4(2), and -28.9(4) kcal/mol, respectively. These are larger than the enthalpies of reaction with MeNC, PhC=CPh, and PhCC-H. (PBu2Me)-Bu-t consistently gives the least amount of enthalpy released, but only when CO (and MeNC) is the reagent does (PPr3)-Pr-i yield a more exothermic enthalpy of reaction than. PCy3. The generally subtle influences on Delta H by (PPr3)-Pr-i and PCy3 are rationalized in terms of the contradictory steric and electronic effects as isopropyl is replaced by cyclohexyl.