trans-[RuCl2(N,N'-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane)] | 536974-58-0

• 英文名称: trans-[RuCl2(N,N'-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane)]
• CAS: 536974-58-0
• 化学式: C₁₇H₂₀Cl₂N₄Ru
• 分子量: 452.349
• InChiKey: GXUSGCKZKMGCLR-JWRHQXMQSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  sodium hexaflorophosphate 、 trans-[RuCl2(N,N'-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane)] 以 水 为溶剂， 以95%的产率得到trans-[Ru(H2O)2(N,N'-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane)](PF6)2
  参考文献：
  名称：

  Spectroscopy, electrochemistry and catalytic properties of rutheniumII complexes containing the tetradentate Schiff base ligand N,N′-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane

  摘要：

  The complexes trans-[RuCl2(bpydip)] and trans-[Ru(OH2)(2)(bpydip)](PF6)(2), where bpydip is the tetradentate Schiff base ligand, N,N'-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane, have been synthesized and characterized by elemental analysis, cyclic voltammetry, UV-Vis, FTIR and H-1 NMR spectroscopy. The electronic spectrum of the trans -[RuCl2(bpydip)] complex has been successfully simulated on the basis of the ZINDO/S method, supporting the assignment of the absorption bands at 644, 607, 458, 418 and 374 nm to Ru-11(d(pi)) --> bpydip(p(pi)*) charge-transfer transitions, and at 282 nm, to a bpydip (pi --> pi*) intraligand transition. The electrochemistry of this complex is characterized by a reversible pair of waves at +0.30 and -1.70 V, ascribed to the Ru-111/11 and bpydip(0/-1) redox couples, respectively. In contact with water, the trans-[RuCl2(bpydip)] complex spontaneously and quantitatively converts into the aqua complex, leading to pronounced changes in the electronic and electrochemical behavior. A remarkable activity in the epoxidation of cyclohexene in the presence of iodosobenzene (PhIO) has been observed for the aqua complex. (C) 2002 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0020-1693(02)01480-9
• 作为产物：
  描述：

  2-乙酰基吡啶 、 水合三氯化钌 、 1,3-丙二胺 在 LiCl 作用下， 以 乙醇 为溶剂， 以23%的产率得到trans-[RuCl2(N,N'-bis(7-methyl-2-pyridylmethylene)-1,3-diiminopropane)]
  参考文献：
  名称：

  De Souza, Vagner Roberto; Da Costa Ferreira, Ana Maria; Toma, Henrique Eisi, Journal of the Chemical Society, Dalton Transactions, 2003, # 3, p. 458 - 463

  摘要：

  DOI：