(triethyl trithiophosphite)iodocopper(I) | 161728-37-6

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫基化合物
• 英文名称: (triethyl trithiophosphite)iodocopper(I)
• CAS: 161728-37-6
• 化学式: C₆H₁₅CuIPS₃
• 分子量: 404.807
• InChiKey: QAZBZPCKUQJBRY-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  1.47
• 重原子数：
  12.0
• 可旋转键数：
  7.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  copper(l) iodide 、 三硫代亚磷酸三乙酯 以 氯仿 为溶剂， 以12%的产率得到(triethyl trithiophosphite)iodocopper(I)
  参考文献：
  名称：

  A New Type of Coordination in Copper(I) Complexes with Trivalent Phosphorus Compounds Containing Phosphorus-Sulfur Bonds

  摘要：

  A series of copper(I) complexes with trialkyl trithiophosphite ligands have been prepared and crystallographically characterized to investigate possible binding modes of potentially tetradentate ligands: (EtS)(3)P . CuHal with Hal Cl, Br, and I; (i-PrS)(3)P . CuBr . CH3CN. Complexes of copper(I) monohalides with triethyl trithiophosphite appeared to be isostructural, exhibiting a bidentate coordination mode via the phosphorus atom of one thiophosphite molecule and the sulfur atom of another, with formation of polymeric chains along the x-axis. In the complex of copper monobromide with triisopropyl trithiophosphite and acetonitrile monodentate coordination via-the phosphorus atom is observed. Crystal data [space group, a, b, c, alpha, beta, gamma, Z (only undefined cell parameters are listed)]: (EtS)(3)P CuCl, monoclinic P2(1)/c, 7.377(2) Angstrom, 14.522(4) Angstrom, 12.275(4) Angstrom, 100.28(2)degrees, 4; (i-PrS)(3)P . CuBr . CHsCN(3)-triclinic P (1) over bar, 8.612(5) Angstrom, 9.401(5) Angstrom, 13.254(5) Angstrom, 81.49(4)degrees, 86.66(4)degrees, 63.24(5)degrees 2.

  DOI：

  10.1021/ic00125a014