[(p-Me-C6H4-CH(CH3)2)2Ru2Cl2(μ-Cl)(μ-H)] | 90720-60-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: [(p-Me-C6H4-CH(CH3)2)2Ru2Cl2(μ-Cl)(μ-H)]
• 英文别名: hydride;1-methyl-4-propan-2-ylbenzene;ruthenium(2+);trichloride
• CAS: 90720-60-8
• 化学式: C₂₀H₂₉Cl₃Ru₂
• 分子量: 577.949
• InChiKey: QEGMCYQVJFSOPG-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  -2.64
• 重原子数：
  25
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  [(p-Me-C6H4-CH(CH3)2)2Ru2Cl2(μ-Cl)(μ-H)] 、 sodium iodide 以 甲醇 为溶剂， 以85%的产率得到[(p-Me-C6H4-CH(CH3)2)2Ru2I2(μ-I)(μ-H)]*C3H6O
  参考文献：
  名称：

  Reactivity of dinuclear arene ruthenium complexes: reactions of the hydrido complex [( p -Me-C 6 H 4 -Pr i ) 2 Ru 2 Cl 2 (μ-Cl)(μ-H)] with NaX and HX (X=F, Cl, Br, I)

  摘要：

  The dinuclear hydride complex [(p-Me-C6H4-Pr')(2)Ru2Cl2(mu-Cl)(mu-H)] (1) reacts with the sodium halides NaX in methanol to give the halogen analogues [(p-Me-C6H4-Pr')(2)Ru2X2(mu-X)(mu-H)] (2: X = F, 3: X = Br, 4: X = I). With HX, complex 1 reacts to give the tetrahalo complexes [(p-Me-C6H4-Pr')(2)Ru2X2(mu-X)(2)] (5: X = Cl, 6: X = Br, 7: X = I); in the case of X = I, a large excess of HI leads to the formation of the cationic complex [(p-Me-C6H4-Pr')(2)Ru-2(mu-I)(3)](+) (8). The X-ray structure analysis of 1 shows a dinuclear Ru-2 backbone with two terminal chloro ligands being irans with respect to each other as the two p-cymene ligands, the two bridging ligands lie in a plane perpendicular to the plane defined by the terminal chloro ligands and the ruthenium atoms. (C) 2000 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(00)00155-8