fac-ClRe(CO)3(4-phenylpyridine)2 | 70805-99-1

• 英文名称: fac-ClRe(CO)3(4-phenylpyridine)2
• CAS: 70805-99-1
• 化学式: C₂₅H₁₈ClN₂O₃Re
• 分子量: 616.09
• InChiKey: MAGLWUNGROYLNY-UHFFFAOYSA-M

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：

  fac-ClRe(CO)3(4-phenylpyridine)2 在 CH₃CN 作用下， 以 乙腈 为溶剂， 生成 Cl2Re2(CO)2(acetonitrile)4(4-phenylpyridine)2*6H2O
  参考文献：
  名称：

  Primary photochemical processes in fac-ClRe(CO)3L2 (L = 4-phenylpyridine and 4-cyanopyridine): a steady-state and flash photochemical study of reaction products and intermediates

  摘要：

  The photochemistry of fac-ClRe(CO)3L2, L = 4-phenylpyridine and 4-cyanopyridine, has been investigated by monochromatic steady-state and flash photolyses between 400 and 229 nm. Two parallel photoprocesses, the photogeneration of the emissive MLCT state and the photoredox dissociation in {ClRe(CO)3L+, L .-} products, have been observed with both compounds. A third photoprocess, namely, the photogeneration of a Re(I)-ligand biradical, has been observed only in photolyses of the 4-phenylpyridine complex. While this Re(I)-ligand biradical reduces Cu(II)(TIM)2+ to the corresponding Cu(I) species, no such reaction is undergone by the MLCT state. Differences between the electronic structures of these complexes, shown by extended Huckel MO calculations, were related to their intrinsic photochemical behavior.

  DOI：

  10.1021/j100180a050