5,5'-bis[2-(4,5-diazafluoren-9-ylimino)phenoxymethyl]-2,2'-bipyridine | 1588821-51-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 5,5'-bis[2-(4,5-diazafluoren-9-ylimino)phenoxymethyl]-2,2'-bipyridine
• 英文别名: N-[2-[[6-[5-[[2-(3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-ylideneamino)phenoxy]methyl]pyridin-2-yl]pyridin-3-yl]methoxy]phenyl]-3,13-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-imine
• CAS: 1588821-51-5
• 化学式: C₄₆H₃₀N₈O₂
• 分子量: 726.797
• InChiKey: RTWQERFRLCRHDQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.2
• 重原子数：
  56
• 可旋转键数：
  9
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.04
• 拓扑面积：
  121
• 氢给体数：
  0
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  顺-双(2,2-二吡啶)二氯化钌(II) 水合物 、 5,5'-bis[2-(4,5-diazafluoren-9-ylimino)phenoxymethyl]-2,2'-bipyridine 、 hexafluorophosphate anion 以 乙二醇甲醚 为溶剂， 反应 12.0h， 生成 [(2,2'-bipyridine)₆Ru₃(5,5'-bis[2-(4,5-diazafluoren-9-ylimino)phenoxymethyl]-2,2'-bipyridine)](PF₆)₆
  参考文献：
  名称：

  Preparation, photophysical, and electrochemical properties of three trinuclear Ru(II) complexes: Bridging ligands composed of 2,2′-bipyridine and 4,5-diazafluorene fragments

  摘要：

  Three bridging.ligands 5,5 '-bis[(4,5-diazafluoren-9-ylimina)methyl]-2,2 '-bipyridine (L-1), 5,5 '-bis[2-(4,5diazafluoren-9-ylimino)phenoxymethyl]-2,2 '-bipyridine (L-2), 5,5 '-bis[4-(4,5-diazafluoren-9-ylimino) phenoxymethyl]-2,2 '-bipyridine (L-3), and corresponding Ru(11) complexes [(bpY)(6)Ru-3(L1-3)](PF6)(6) (bPY=2,2 '-bipyridine) have been synthesized. The three ligands have two kinds of nonequivalent chelating sites: one involving the 2,2 '-bipyridine moiety, and the other involving the 4,5-diazafluorene moiety. The emission intensities of complexes [(bPY)(6)Ru-3(L-2)](6+) and 1(bPY)6Ru3(L3)l(6+) are almost equal to that of complex [(bPY)(6)Ru-3(L-1)](6+) in CH3CN solution at room temperature, but weaker than that of complex [(bPY)(6)Ru-3(L-1)](6+) in EtOH-MeOH (4:1, v/v) glassy matrix at 77 K. Cyclic voltammetry and differential pulse voltammetry studies of the three complexes show one Ru(11)-centered oxidation at around 1.33 V for the Ru (II/III) couple. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2014.01.013
• 作为产物：
  描述：

  9-(2-hydroxy)phenylimino-4,5-diazafluorene 、 5,5'-二溴甲基-2,2'-联吡啶 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 5,5'-bis[2-(4,5-diazafluoren-9-ylimino)phenoxymethyl]-2,2'-bipyridine
  参考文献：
  名称：

  Preparation, photophysical, and electrochemical properties of three trinuclear Ru(II) complexes: Bridging ligands composed of 2,2′-bipyridine and 4,5-diazafluorene fragments

  摘要：

  Three bridging.ligands 5,5 '-bis[(4,5-diazafluoren-9-ylimina)methyl]-2,2 '-bipyridine (L-1), 5,5 '-bis[2-(4,5diazafluoren-9-ylimino)phenoxymethyl]-2,2 '-bipyridine (L-2), 5,5 '-bis[4-(4,5-diazafluoren-9-ylimino) phenoxymethyl]-2,2 '-bipyridine (L-3), and corresponding Ru(11) complexes [(bpY)(6)Ru-3(L1-3)](PF6)(6) (bPY=2,2 '-bipyridine) have been synthesized. The three ligands have two kinds of nonequivalent chelating sites: one involving the 2,2 '-bipyridine moiety, and the other involving the 4,5-diazafluorene moiety. The emission intensities of complexes [(bPY)(6)Ru-3(L-2)](6+) and 1(bPY)6Ru3(L3)l(6+) are almost equal to that of complex [(bPY)(6)Ru-3(L-1)](6+) in CH3CN solution at room temperature, but weaker than that of complex [(bPY)(6)Ru-3(L-1)](6+) in EtOH-MeOH (4:1, v/v) glassy matrix at 77 K. Cyclic voltammetry and differential pulse voltammetry studies of the three complexes show one Ru(11)-centered oxidation at around 1.33 V for the Ru (II/III) couple. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2014.01.013