cis-[(1,2-bis(diphenylphosphino)ethane)Pd(SC2H5)2] | 108539-01-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: cis-[(1,2-bis(diphenylphosphino)ethane)Pd(SC2H5)2]
• 英文别名: 2-Diphenylphosphanylethyl(diphenyl)phosphane;ethanethiolate;palladium(2+)
• CAS: 108539-01-1
• 化学式: C₃₀H₃₄P₂PdS₂
• 分子量: 627.099
• InChiKey: HSXBLKSDNUFQMP-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  6.36
• 重原子数：
  35
• 可旋转键数：
  7
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  2
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  cis-[(1,2-bis(diphenylphosphino)ethane)Pd(SC2H5)2] 、 [Pd(η3-C4H7)(C6H5CN)2][ClO4] 以 甲醇 为溶剂， 以59%的产率得到[(1,2-bis(diphenylphosphino)ethane)Pd(μ-SEt)2Pd(η3-C4H7)][ClO4]
  参考文献：
  名称：

  Synthesis and characterization of heterodinuclear thiolate complexes containing the Pd(η3-allyl)+ moiety. Crystal structure of [(dppe)Pd(μ-SC6H4Me-p)2Pd(η3-C3H5)][ClO4]

  摘要：

  Hetero dinuclear complexes of the types [(dppe)M(mu-SR)(2)Pd(eta(3)-allyl)][ClO4] (M = Pd or Pt) and [(dppe)Pt(mu-SC2H4S)Pd(eta(3)-allyl)][ClO4] [dppe = 1,2-bis(diphenylphosphino)ethane; allyl = C3H5 or C4H7] have been obtained by reaction of the corresponding cis-dithiolato complexes, [M(SR)(2) (dppe)] or [Pt(SC2H4S)(dppe)]. and [Pd(eta(3)-allyl)(PhCN)(2)][ClO4]. The identity of these complexes has been established by NMR (H-1 and P-31) spectroscopy. The crystal structure of [(dppe)Pd(mu-SC6H4Me-p)(2)Pd(eta(3)-C3H5)][ClO4] has been determined by single-crystal X-ray methods. The p-tolyl groups on the sulfur atoms adopt a syn conformation with respect to the central Pd-S-2-Pd core. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0277-5387(00)00440-x