1,6-diferrocenyl-N,N'-bis(2-hydroxypropyl)-2,5-diazahexane | 333718-87-9

• 英文名称: 1,6-diferrocenyl-N,N'-bis(2-hydroxypropyl)-2,5-diazahexane
• CAS: 333718-87-9
• 化学式: C₃₀H₄₀Fe₂N₂O₂
• 分子量: 572.354
• InChiKey: XPYKQZSTQIOWIN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
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• 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：
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反应信息

• 作为反应物：
  描述：

  ammonium hexafluorophosphate 、 [ReOCl₃(PPh₃)₂] 、 1,6-diferrocenyl-N,N'-bis(2-hydroxypropyl)-2,5-diazahexane 在 NaOAc 作用下， 以 乙醚 、 乙醇 为溶剂， 以39%的产率得到(N,N'-bis(ferrocenylmethyl)-4,7-diazadecane-2,9-dioxo-N2O2)-triphenylphosphineoxorhenium(V) hexafluorophosphate
  参考文献：
  名称：

  Structures of a Tetradentate Ferrocenyl Ligand and Its Oxorhenium(V) Complex in Solution and in the Solid State

  摘要：

  The novel ferrocenyl ligand rac-1,6-diferrocenyl-N,N'-bis(2-hydroxypropyl) (1, H2L) was synthesized from ferrocenylcarboxaldehyde and ethylenediamine followed by the reduction of the Schiff base with LiAlH4 and subsequent N-alkylation with 1,2-propyleneoxide. The dianion of H2L reacted with [ReO(PPh3)(2)Cl-3], and the product was treated with NH4PF6 to afford the complex [ReO(L-N2O2)PPh3]PF6 (2). Both the ferrocenyl ligand and the complex were characterized in solution by NMR spectroscopy and in the solid state by single-crystal X-ray diffraction studies. NMR investigations reveal two solvent-dependent isomers for the ferrocenyl ligand in solution of which the major form is the more ordered one. The cation of 2 displays a nonsymmetrically coordinated N2O2 ligand.

  DOI：

  10.1021/ic000746y
• 作为产物：
  描述：

  N,N'-bis(ferrocenylmethyl)ethylenediamine 、 methyloxirane 以 乙醇 为溶剂， 以97%的产率得到1,6-diferrocenyl-N,N'-bis(2-hydroxypropyl)-2,5-diazahexane
  参考文献：
  名称：

  Structures of a Tetradentate Ferrocenyl Ligand and Its Oxorhenium(V) Complex in Solution and in the Solid State

  摘要：

  The novel ferrocenyl ligand rac-1,6-diferrocenyl-N,N'-bis(2-hydroxypropyl) (1, H2L) was synthesized from ferrocenylcarboxaldehyde and ethylenediamine followed by the reduction of the Schiff base with LiAlH4 and subsequent N-alkylation with 1,2-propyleneoxide. The dianion of H2L reacted with [ReO(PPh3)(2)Cl-3], and the product was treated with NH4PF6 to afford the complex [ReO(L-N2O2)PPh3]PF6 (2). Both the ferrocenyl ligand and the complex were characterized in solution by NMR spectroscopy and in the solid state by single-crystal X-ray diffraction studies. NMR investigations reveal two solvent-dependent isomers for the ferrocenyl ligand in solution of which the major form is the more ordered one. The cation of 2 displays a nonsymmetrically coordinated N2O2 ligand.

  DOI：

  10.1021/ic000746y