[aquo(nitrosyl)(meso-tetra-p-tolylporphyrinato)ruthenium(II)][hexafluorophosphate] | 215526-05-9

• 英文名称: [aquo(nitrosyl)(meso-tetra-p-tolylporphyrinato)ruthenium(II)][hexafluorophosphate]
• CAS: 215526-05-9
• 化学式: C₄₈H₃₈N₅O₂Ru*F₆P
• 分子量: 962.896
• InChiKey: BMZROVUIVKESFB-ZEZVWJHESA-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

• 作为反应物：
  描述：

  tetra-n-butylammonium hydroxide 、 [aquo(nitrosyl)(meso-tetra-p-tolylporphyrinato)ruthenium(II)][hexafluorophosphate] 以 乙腈 为溶剂， 以84%的产率得到hydroxo(nitrosyl)(meso-tetra-p-tolylporphyrinato)ruthenium(II)
  参考文献：
  名称：

  Synthesis and Axial Ligand Substitution Chemistry of Ru(TTP)(NO)X. Structures of Ru(TTP)(NO)X (X = ONO, OH)

  摘要：

  New complexes of the family Ru(TTP)(NO)X, where TTP = tetra-p-tolylporphyrinato dianion, and X = OMe, Cl, OH, SH, S-p-tolyl, O2CH, ONO, ONO2, N-3, or NCS, have been prepared by a variety of high-yield metathesis techniques from Ru(TTP)(CO)(MeOH). New complexes have been characterized by IR, NMR, and UV spectroscopies as well as by cyclic voltammetry, elemental analysis, and, in two cases, by X-ray crystallography. The two complexes which have been characterized by single-crystal X-ray diffraction, the hydroxide and nitrite complexes 6 and 10 both crystallize in the monoclinic space group P2(1)/n and have Z = 6, with two independent metalloporphyrins in the unit cell, one (ordered) lying on a general position and the other (disordered) with the ruthenium on an inversion center. Acid labilization of the methoxide results in facile substitution kinetics at room temperature and with the exception of the sulfhydryl complex, L = SH, the resulting complexes are air stable and thermally robust species. For example, the formate derivative cannot be decarboxylated thermally or photolytically to give a hydride complex, and the azido complex does not eliminate dinitrogen under similar conditions to give a nitrido complex.

  DOI：

  10.1021/ic980182m
• 作为产物：
  描述：

  hexafluorophosphoric acid 、 methoxide(nitrosyl)(meso-tetra-p-tolylporphyrinato)ruthenium(II) 、 水 以 二氯甲烷 为溶剂， 以82%的产率得到[aquo(nitrosyl)(meso-tetra-p-tolylporphyrinato)ruthenium(II)][hexafluorophosphate]
  参考文献：
  名称：

  Synthesis and Axial Ligand Substitution Chemistry of Ru(TTP)(NO)X. Structures of Ru(TTP)(NO)X (X = ONO, OH)

  摘要：

  New complexes of the family Ru(TTP)(NO)X, where TTP = tetra-p-tolylporphyrinato dianion, and X = OMe, Cl, OH, SH, S-p-tolyl, O2CH, ONO, ONO2, N-3, or NCS, have been prepared by a variety of high-yield metathesis techniques from Ru(TTP)(CO)(MeOH). New complexes have been characterized by IR, NMR, and UV spectroscopies as well as by cyclic voltammetry, elemental analysis, and, in two cases, by X-ray crystallography. The two complexes which have been characterized by single-crystal X-ray diffraction, the hydroxide and nitrite complexes 6 and 10 both crystallize in the monoclinic space group P2(1)/n and have Z = 6, with two independent metalloporphyrins in the unit cell, one (ordered) lying on a general position and the other (disordered) with the ruthenium on an inversion center. Acid labilization of the methoxide results in facile substitution kinetics at room temperature and with the exception of the sulfhydryl complex, L = SH, the resulting complexes are air stable and thermally robust species. For example, the formate derivative cannot be decarboxylated thermally or photolytically to give a hydride complex, and the azido complex does not eliminate dinitrogen under similar conditions to give a nitrido complex.

  DOI：

  10.1021/ic980182m