Ru(η6-C6H6)(MePPri2)Cl(CNC5H4N) | 302911-29-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: Ru(η6-C6H6)(MePPri2)Cl(CNC5H4N)
• 英文别名: benzene;chlororuthenium(1+);methyl-di(propan-2-yl)phosphane;pyridine-4-carbonitrile;hexafluorophosphate
• CAS: 302911-29-1
• 化学式: C₁₉H₂₇ClN₂PRu*F₆P
• 分子量: 595.898
• InChiKey: CIZAXZWNOGATGU-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  9.62
• 重原子数：
  31
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  36.7
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  4-氰基吡啶 、 ammonium hexafluorophosphate 、 [Ru(η6-C6H6)Cl2(MePPri2)] 以 甲醇 为溶剂， 以65%的产率得到Ru(η6-C6H6)(MePPri2)Cl(CNC5H4N)
  参考文献：
  名称：

  Synthesis and spectroscopic properties of cationic Ru(II) arene complexes [Ru(η6-arene)(P)Cl(L)]+. (P=PPh3, PEt3, MePPri2 and L=4-cyanopyridine or 1,4-dicyanobenzene)

  摘要：

  Reactions of [Ru(eta(6)-arene)(P)Cl-2] (P = PPh3, PEt3 or MePPr'(2)) with organonitriles 4-cyanopyridine or 1,4-dicyanobenzene (referred hereafter as CNPy or DCB) in methanol, in the presence of NH4PF6, gives the cationic arene complexes [Ru(eta(6)-arene)(P)Cl(L)](+) (L = CNPy or DCB). The reaction products have been characterized by physico-chemical methods viz., elemental analyses, IR, H-1- C-13-, P-31-NMR, electronic and FAB mass spectra. The spectral data of the complexes revealed the presence of a pendant nitrile group. These could behave as potential metallo-ligands and could find wide application in the syntheses of homo- or heterobimetallic mixed valence bridged complexes. (C) 2000 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(00)00258-8