benzenethiolate;gold(1+);triphenylphosphane | 209847-42-7

• 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: benzenethiolate;gold(1+);triphenylphosphane
• CAS: 209847-42-7
• 化学式: C₄₈H₄₀Au₂P₂S₂
• 分子量: 1136.86
• InChiKey: JVFUATDOCIIWCZ-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  10.07
• 重原子数：
  54.0
• 可旋转键数：
  13.0
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  重氮甲烷 、 benzenethiolate;gold(1+);triphenylphosphane 以 乙醚 、 苯 为溶剂， 生成
  参考文献：
  名称：

  Hypercoordinated gold (i) compounds

  摘要：

  The reaction of [O(AuPPh3)(3)](+)BF4(-) with a Li,K derivative of o-cresol followed by the interaction of the reaction product with CO2 gave (triphenylphosphine)gold acetate. The reaction of ClAuPPh3 with o-LiC6H4SLi afforded (triphenylphosphine)go Id thiophenoxide. According to the data of X-ray structural analysis, the latter occurs as a dimer formed through an intermolecular secondary Au...Au bond. The reaction of this complex with diazomethane was accompanied by insertion of carbene into the Au-S bond to form a new gold complex, PhSCH2AuPPh3. The reactions with PPh3Au+BF4- or HBF4 yielded a new tetranuclear gold thiocluster, {[PhS(AuPPh3)(2)](2+)(BF4-)}(2), which involves Au...Au bonds that differ in strength. The structures of the compounds obtained were established by X-ray structural analysis, H-1 and P-31 NMR spectroscopy, and FAB mass spectrometry.

  DOI：

  10.1007/bf02498963
• 作为产物：
  描述：

  三苯基膦氯金 、 Lithium 2-lithiobenzenethiolate 生成 benzenethiolate;gold(1+);triphenylphosphane
  参考文献：
  名称：

  Kuz'mina; Baukova; Churakov, Russian Journal of Coordination Chemistry, 1997, vol. 23, # 4, p. 279 - 288

  摘要：

  DOI：