[Cu(2,9-bis(trifluoromethyl)-1,10-phenanthroline)2](PF6) | 210770-02-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• 英文名称: [Cu(2,9-bis(trifluoromethyl)-1,10-phenanthroline)2](PF6)
• 英文别名: [Cu(2,9-bis(trifluoromethyl)-1,10-phenanthroline)2]PF6；2,9-Bis(trifluoromethyl)-1,10-phenanthroline;copper(1+);hexafluorophosphate
• CAS: 210770-02-8
• 化学式: C₂₈H₁₂CuF₁₂N₄*F₆P
• 分子量: 840.921
• InChiKey: SYCANMRPNMYCKG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.02
• 重原子数：
  52
• 可旋转键数：
  0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  51.6
• 氢给体数：
  0
• 氢受体数：
  23

反应信息

• 作为产物：
  描述：

  tetrakis(actonitrile)copper(I) hexafluorophosphate 、 2,9-bis(trifluoromethyl)-1,10-phenanthroline 以 二氯甲烷 为溶剂， 以76%的产率得到[Cu(2,9-bis(trifluoromethyl)-1,10-phenanthroline)2](PF6)
  参考文献：
  名称：

  A Photoluminescent Copper(I) Complex with an Exceptionally High CuII/CuI Redox Potential: [Cu(bfp)2]+ (bfp=2,9-bis(trifluoromethyl)-1,10-phenanthroline)

  摘要：

  Unprecedented stabilization of the copper(I) oxidation state is demonstrated for the complex cation [Cu(bfp)2 ]+ (1) due to the steric and electronic effects of the CF3 groups (E1/2 (CuII /CuI )=+1.55 V vs. SCE). The redox existence range of the copper(I) species is remarkably high at 2.77 V. It is emissive in solution at room temperature and shows great potential as a photocatalyst; in the excited state it is a very potent photooxidant.

  DOI：

  10.1002/(sici)1521-3773(19980619)37:11<1556::aid-anie1556>3.0.co;2-w