[Re(4,4'-Me2-2,2'-bipyridine)(CO)3(P(OEt)3)] | 199539-68-9

• 英文名称: [Re(4,4'-Me2-2,2'-bipyridine)(CO)3(P(OEt)3)]
• CAS: 199539-68-9
• 化学式: C₂₁H₂₇N₂O₆PRe
• 分子量: 620.636
• InChiKey: SNFFWOXYLMFIHU-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

• 作为产物：
  描述：

  [Re(4,4'-Me2-2,2'-bipyridine)(CO)3(P(OEt)3)](PF6) 以 N,N-二甲基甲酰胺 为溶剂， 生成 [Re(4,4'-Me2-2,2'-bipyridine)(CO)3(P(OEt)3)]
  参考文献：
  名称：

  Key Process of the Photocatalytic Reduction of CO₂ Using [Re(4,4‘-X₂-bipyridine)(CO)₃PR₃]⁺ (X = CH₃, H, CF₃; PR₃ = Phosphorus Ligands):  Dark Reaction of the One-Electron-Reduced Complexes with CO₂

  摘要：

  Reduction of CO2 to CO was efficiently photocatalyzed by [Re(4,4'-X(2)bpy)(CO)(3)PR3](+) (X = H, Me; PR3 = P(OEt)(3), P(O-i-Pr)(3)) in quantum yields of 0.16-0.20. Complexes with CF3 as X or trialkylphosphine as PR3 have much lower photocatalytic ability. One-electron-reduced species of the complexes, which were produced by the photoinduced electron-transfer reaction with triethanolamine, reacted with CO2 in the dark with rate constants of 3.5 x 10(-4)-1.9 x 10(-2) M-1 s(-1). The faster the rate of this process, the higher the quantum yield of CO formation. The calculated amount of CO formation, based on the assumption that the process gives CO quantitatively, was similar to the actually observed amount under various conditions. This is consistent with the thermal process being one of the rate-limiting steps in the photocatalyzed reduction of CO2 by the rhenium complexes.

  DOI：

  10.1021/om970608p