[(η6-p-cymene)Ru(κ2-O,O-acetylacetonate)(acetonitrile)][B(3,5-(CF3)2C6H3)4] | 1054536-43-4

• 英文名称: [(η6-p-cymene)Ru(κ2-O,O-acetylacetonate)(acetonitrile)][B(3,5-(CF3)2C6H3)4]
• 英文别名: [(η6-p-cymene)Ru(κ2-O,O-acac)(MeCN)][B(3,5-(CF3)2C6H3)4]
• CAS: 1054536-43-4
• 化学式: C₁₇H₂₄NO₂Ru*C₃₂H₁₂BF₂₄
• 分子量: 1238.67
• InChiKey: JHBVOASVVIOQTK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  [(η6-p-cymene)Ru(κ2-O,O-acetylacetonate)(tetrahydrofuran)][B(3,5-(CF3)2C6H3)4] 、 乙腈 以 乙腈 为溶剂， 以88%的产率得到[(η6-p-cymene)Ru(κ2-O,O-acetylacetonate)(acetonitrile)][B(3,5-(CF3)2C6H3)4]
  参考文献：
  名称：

  Ruthenium(II) complexes possessing the η6-p-cymene ligand

  摘要：

  Complexes possessing a soft donor eta(6)-arene and hard donor acetylacetonate ligand, [(eta(6)-p-cymene) Ru(kappa(2)-O,O-acac-mu-CH)](2)[OTf](2) (1) (OTf = trifluoromethanesulfonate; acac = acetylacetonate) and [(eta(6)-p-cymene)Ru(kappa(2)-O,O-acac)(THF)][BAr'(4)] (2) {Ar' = 3,5-(CF3)-C6H3}, were prepared and fully characterized. The lability of the mu-CH linkage for complex 1 and the THF ligand of 2 allow access to the unsaturated cation [(eta(6)-p-cymene) Ru(kappa(2)-O,O-acac)](+). The reaction of [(eta(6)-p-cymene)Ru(kappa(2)-O,O-acac)(THF)][BAr'(4)] (2) with KTp {Tp = hydridotris(pyrazolyl)borate} produces [TpRu(eta(6)-p-cymene)][BAr'(4)] (5). The azide complex [(eta(6)-p-cymene)Ru(kappa(2)-O,O-acac) (N3Ar)][BAr'(4)] (6) forms upon reaction of [(eta(6)-p-cymene)Ru(kappa(2)-O,O-acac)(THF)][BAr'(4)] (2) with N3Ar (Ar = p-tolyl), and reaction of [(eta(6)-p-cymene)Ru(kappa(2)-O,O-acac)(THF)][BAr'(4)] (2) with CHCl3 at 100 degrees C yields the chloride-bridged binuclear complex [{(eta(6)-p-cymene)Ru}(2)(mu-Cl)(3)][BAr'(4)] (7). The details of solid-state structures of [(eta(6)-p-cymene)Ru(kappa(2)-O,O-acac-mu-CH)](2)[OTf](2) (1), [TpRu(eta(6)-p-cymene)][BAr'(4)] (5) and [{(eta(6)-p-cymene)Ru}(2)(mu-Cl)(3)][BAr'(4)] (7) are disclosed. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2007.10.012