[Ru(4,4'-dimethyl-2,2'-bipyridine)(CO)2Cl(C(O)OCH2CH2OH)] | 325740-62-3

• 英文名称: [Ru(4,4'-dimethyl-2,2'-bipyridine)(CO)2Cl(C(O)OCH2CH2OH)]
• CAS: 325740-62-3
• 化学式: C₁₇H₁₇ClN₂O₅Ru
• 分子量: 465.855
• InChiKey: FFMUIIYRVMBDKT-UHFFFAOYSA-M

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：

  4,4'-二甲基-2,2'-联吡啶 、 dichlorotricarbonylruthenium(II) dimer 、 乙二醇 以 乙二醇 为溶剂， 生成 [Ru(4,4'-dimethyl-2,2'-bipyridine)(CO)2Cl(C(O)OCH2CH2OH)]
  参考文献：
  名称：

  Experimental and theoretical approaches to the reactions of ruthenium-4,4′-dimethyl-2,2′-bipyridine carbonyl complexes

  摘要：

  The reactions of ruthenium-4,4'-dimethyl-2,2'-bipyridine (4,4'-dmbpy) carbonyl complexes were investigated by experimental and computational methods. The reaction route from [Ru(CO)(3)Cl-2](2) and 4,4'-dmbpy in ethylene glycol proceeded in several consecutive steps to dimeric [Ru(4,4'-dmbpy)(CO)(2)Cl](2). The intermediates in each Step were isolated and characterized using spectroscopic methods. Total reaction energies were calculated by non-local density functional methods. Electron donating methyl groups have been suggested to cause changes in the electronic environment of the ruthenium central atom, thus affecting the catalytic properties of these complexes. The reactions of ruthenium-4,4'-dmbpy complexes in ethylene glycol were compared to the related reactions of analogous ruthenium-2,2'-bipyridine complexes in order to determine the influence of peripheric methyl substituents on the reactivities of the complexes. (C) 2000 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0020-1693(00)00251-6