bis(triisopropylsilylethynyl)tetrakis(N,N'-dimethyl-3-methoxybenzamidinato)diruthenium(III) | 637359-50-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: bis(triisopropylsilylethynyl)tetrakis(N,N'-dimethyl-3-methoxybenzamidinato)diruthenium(III)
• 英文别名: Ru2(N,N'-dimethyl-3-(methoxy)benzamidinate)4(triisopropylsilylethynyl)2
• CAS: 637359-50-3
• 化学式: C₆₂H₉₄N₈O₄Ru₂Si₂
• 分子量: 1273.79
• InChiKey: FFLFGLFIDURZDL-UHFFFAOYSA-N

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：
  None
• 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：

  二茂铁乙炔 、 dichlorotetrakis(N,N'-dimethyl-3-methoxybenzamidinato)diruthenium(III) 、 三异丙基硅基乙炔 在 n-BuLi 作用下， 以 四氢呋喃 为溶剂， 以43%的产率得到Ru2(N,N'-dimethyl-3-(methoxy)benzamidinate)4(ferrocenylethynyl)(triisopropylsilylethynyl)
  参考文献：
  名称：

  Strong Electronic Couplings between Ferrocenyl Centers Mediated by Bis-Ethynyl/Butadiynyl Diruthenium Bridges

  摘要：

  A series of trans-(FcC(2n))Ru-2(Y-DMBA)(4)(C(2m)Fc) with n, m = 1 and 2 and Y-DMBA as N,N'-dimethylbenzamidinate or N,N'-dimethyl-(3-methoxy)benzamidinate have been synthesized and characterized. The intramolecular Fc center dot center dot center dot Fc distances, established through single-crystal X-ray diffraction studies, range from 11.6 to 16.6 angstrom. Results from both voltammetric and spectroelectrochemical studies indicate that the (-C-2n)Ru-2(Y-DMBA)(4)(C-2m-) fragments are among the most efficient mediators of intramolecular hole transfer. Density-functional calculations offer both the insight on the ground-state electronic properties and unambiguous assignment for the observed electronic absorptions.

  DOI：

  10.1021/ja0534452