[Fe(py)(NO2)(C6H4(NHCOC5H4N)2)] | 918147-99-6

• 英文名称: [Fe(py)(NO2)(C6H4(NHCOC5H4N)2)]
• CAS: 918147-99-6
• 化学式: C₂₃H₁₇FeN₆O₄
• 分子量: 497.273
• InChiKey: VKNUKBBJPBPXAY-UHFFFAOYSA-L

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：

  [Fe(py)(NO2)(C6H4(NHCOC5H4N)2)] 、 二氧化氮 、 N,N-二甲基甲酰胺 以 N,N-二甲基甲酰胺 、 乙腈 为溶剂， 生成 [Fe(DMF)(NO3)(NO2C6H3(NHCOC5H4N)2)]
  参考文献：
  名称：

  Reactions of Nitric Oxide with a Low-Spin Fe(III) Center Ligated to a Tetradentate Dicarboxamide N₄ Ligand:  Parallels between Heme and Non-heme Systems

  摘要：

  Reaction of excess NO with the non-heme Fe(III) complex [(bpb)Fe(py)2]ClO4 in MeCN under strictly anaerobic conditions affords the {Fe-NO}6(nitro)(nitrosyl) complex [(bpb)Fe(NO)(NO2)] (1) via metal-promoted NO disproportionation, while in a MeOH/MeCN mixture, the same reaction leads to reductive nitrosylation and generation of the {Fe-NO}7 species [(bpb)Fe(NO)] (2). Exposure of a solution of 1 in DMF to dioxygen leads to formation of the ring-nitrosylated product [(bpb-NO2)Fe(NO3)(DMF)] (3). The present system therefore exhibits all the NO reactivities reported so far with the iron-porphyrins.

  DOI：

  10.1021/ja040015n