| 89709-79-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 89709-79-5
• 化学式: C₅₂H₄₈Cl₂MoP₄
• 分子量: 963.694
• InChiKey: KWHANUKUKIFYCU-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  11.88
• 重原子数：
  59.0
• 可旋转键数：
  9.0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  0.0

反应信息

• 作为反应物：
  描述：

  在 Na/Hg 、 triphenylphosphine 、 N₂ 作用下， 以 四氢呋喃 为溶剂， 以75%的产率得到Mo(N2)2(triphos)(PPh3)
  参考文献：
  名称：

  Electrochemical generation of low-valent molybdenum tri-tertiary phosphine complexes: interactions with monophosphines and molecular nitrogen

  摘要：

  The electrochemical reduction of the 15-electron molybdenum(III) complex [MoCl3(dpepp)], dpepp = Ph2PCH2CH2P(Ph)CH2CH2PPh2, has been studied in the presence of PPh3 under argon and under molecular nitrogen. The primary reduction of the trichloride involves a reversible single-electron transfer to give the unstable 1 6-electron molybdenum(II) anion [MoCl3(dpepp)]-. Loss of chloride from this anion prior to or following further electron transfer provides two principal pathways to molybdenum(o) products, [Mo(eta-6-C6H5PPh2)(dpepp)] under Ar or cis-[Mo(N2)2(dpepp)(PPh3)] under molecular nitrogen, a relatively high potential pathway via molybdenum(i) solvated intermediates and a low potential pathway via trans- [MoCl2(dpepp) (PPh3)]. The cis-dinitrogen complex is unstable on the preparative time-scale, small amounts of trans- [Mo(N2)2(dpepp) (PPh3] are formed, presumably by isomerisation, but the major product is the eta-6-arene complex.

  DOI：

  10.1039/dt9920002263