H5O2[Ru2N(2,2'-bipyridine)2Cl6] | 163045-35-0

• 英文名称: H5O2[Ru2N(2,2'-bipyridine)2Cl6]
• CAS: 163045-35-0
• 化学式: C₂₀H₁₆Cl₆N₅Ru₂*H₅O₂
• 分子量: 778.277
• InChiKey: IHHHKRIZIPWZDF-UHFFFAOYSA-H

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：

  盐酸 、 硝酸 、 trans-[(2,2'-bipyridine)dicarbonyldichloridoruthenium(II)] 、 (2,2'-bipyridyl)nitrosylruthenium trichloride 、 (2,2'-bipyridyl)nitrosylruthenium trichloride 以 盐酸 、 硝酸 为溶剂， 生成 H5O2[Ru2N(2,2'-bipyridine)2Cl6]
  参考文献：
  名称：

  Reactions of [Ru(bpy)(CO)2Cl2] in Acidic Media: Formation and Structural Characterization of [Ru(bpy)Cl3(NO)], [Ru2N(bpy)2Cl5(H2O)], and (H5O2)[Ru2N(bpy)2Cl6]

  摘要：

  Reactions of [Ru(bpy)(CO)(2)Cl-2] in concentrated HCl/HNO3 solutions at high temperatures were studied. In acidic solutions carbonyl groups are lost and replaced by chlorine and nitrosyl, nitrido or water ligands. Formation of [Ru(bpy)Cl-3(NO)] and [Ru2N(bpy)(2)Cl-5(H2O)] was time-dependent; with shorter reaction times (<6 h, 240 degrees C) solid crystalline fac(Cl)-[Ru(bpy)Cl-3(NO)] (1a) and mer(Cl)- [Ru(bpy)Cl-3(NO)] (1b) were formed, and with longer reaction times a new crystalline nitrido-bridged complex [Ru2N(bpy)(2)Cl-5(H2O)] (2) was produced, most probably via a nitrosyl intermediate. Both 1 and 2 are practically insoluble and highly stable. However, the reaction of [Ru(bpy)(CO)(2)Cl-2] in HCl/HNO3 solution with small amounts of [Ru(bpy)Cl-3(NO)] added gave in low yield another nitrido-bridged product, (H5O2)[Ru2N(bpy)(2)Cl-6] (3). The role of added [Ru(bpy)Cl-3(NO)] in this reaction is unclear, and it is possible that (3) may also form directly from pure [Ru(bpy)(CO)(2)Cl-2]. Crystal structures of fac(Cl)-[Ru(bpy)Cl-3(NO)], mer(Cl)- [Ru(bpy)Cl-3(NO)], [Ru2N(bpy)(2)Cl-5(H2O)], and (H5O2)[Ru2N(bpy)(2)Cl-6] showed that the ruthenium atoms are octahedrally coordinated in all complexes. Crystal data: 1a, monoclinic, space 6.798(3) Angstrom, b = 11.993(4) Angstrom, c = 16.760(8) Angstrom, beta = 98.89(3)degrees, Z = 4; 1b, monoclinic, space group Pn, a = 8.175(2) Angstrom, b = 6.733(2) Angstrom, c = 12.594(5) Angstrom, beta = 105.06(3)degrees, Z = 2; 2, monoclinic, space group P2(1)/n, a = 10.133(5) Angstrom, b = 15.042(6) Angstrom, c = 16.506(8) Angstrom, beta = 104.86(4)degrees, Z = 4; 3, triclinic, space group P ($) over bar 1, a = 10.281(3) Angstrom, b = 10.776(3) Angstrom, c = 12.527(5) Angstrom, alpha = 90.78(3)degrees, beta = 98.31(3)degrees, gamma = 100.91(2)degrees, Z = 2.

  DOI：

  10.1021/ic00115a021