[Ru(tetraphenylporphyrin(2-))(CO)(H2O)] | 849904-78-5

• 英文名称: [Ru(tetraphenylporphyrin(2-))(CO)(H2O)]
• 英文别名: [Ru(TPP)(CO)(H2O)]；Ru(CO)(H2O)(5,10,15,20-tetraphenylporphyrinate)；[Ru(5,10,15,20-tetraphenylporphyrinato)(CO)(H2O)]
• CAS: 849904-78-5
• 化学式: C₄₅H₃₀N₄O₂Ru
• 分子量: 759.829
• InChiKey: QHLCWJVLRWQJME-NBICUONBSA-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：

  异烟酸 、 [Ru(tetraphenylporphyrin(2-))(CO)(H2O)] 以 二氯甲烷 为溶剂， 生成 [Ru(5,10,15,20-tetraphenylporphyrinato)(CO)(4-pyridinecarboxylic acid)]
  参考文献：
  名称：

  Synthesis of calix[4]arene-bis(tin(Iv)porphyrins) and supramolecular complexes on their basis

  摘要：

  Selective substitution of one of the two trans hydroxy groups of calix[4]arene-bis(porphyrinatotin(IV)) resulted in supramolecular tetramer assemblies based thereon with parallel and perpendicular arrangement of tetrapyrrole macrocyclic rings, which were characterized by UV spectroscopy, 1H NMR, and elemental analysis data.

  DOI：

  10.1134/s0036023612030187
• 作为产物：
  描述：

  Ru(II)(5,10,15,20-tetraphenylporphyrinato)(CO)(MeOH) 以 乙醇 、 二氯甲烷 为溶剂， 生成 [Ru(tetraphenylporphyrin(2-))(CO)(H2O)]
  参考文献：
  名称：

  与烯烃催化环氧化有关的钌-卟啉配合物的结构测定。

  摘要：

  从[Ru（II）（TPP）（CO）L]（L =无或无）开始可合成的高效环氧化催化剂[Ru（VI）（TPP）（O）2）（TPP =四苯基卟啉二价阴离子）描述了CH 3 OH）。通过使用从头开始的X射线粉末衍射（XRPD）方法确定复合物的分子结构，并通过NMR技术（例如PGSE（脉冲场梯度自旋回波）测量）详细研究了其溶液行为。[Ru（IV）（TPP）（OH）] 2O是合成[Ru（VI）（TPP）（O）2]的一种副产物，它是通过氧化[Ru（II）（ TPP）（CO）L]或[Ru（VI）（TPP）（O）2]与[Ru（II）（TPP）（CO）L]的共配比反应，然后通过XRPD确定其分子结构分析。[Ru（VI）（TPP）（O）2]可通过二甲亚砜或一氧化碳还原，生成[Ru（II）（TPP）（S-DMSO）2]或[Ru（II）（TPP）（ CO）（H2O）]。通过常规的单晶X射线衍射分析对这两种物质进行了表征。

  DOI：

  10.1021/ic048587w

文献信息

• Synthesis and spectroscopic characterization of Ru(II) and Sn(IV)-porphyrins supramolecular complexes
  作者：I.A. Khodov、M.Yu. Nikiforov、G.A. Alper、G.M. Mamardashvili、N.Zh. Mamardashvili、O.I. Koifman

  DOI：10.1016/j.molstruc.2014.10.070

  日期：2015.2

  studies of Ru(II) and Sn(IV) tetraphenylporphyrins supramolecular complexes were carried out. The diffusion coefficients of the complexes, porphyrinates, and solvents were determined by DOSY NMR spectroscopy. By the method of spectrophotometric titration a binding ability of Ru(II) tetraphenylporphyrin towards 4-(imidazol-1-yl)-phenol was investigated, stability constant of resulting complexes and concentration

  进行了 Ru(II) 和 Sn(IV) 四苯基卟啉超分子配合物的合成和核磁共振研究。配合物、卟啉酸盐和溶剂的扩散系数由 DOSY NMR 光谱测定。通过分光光度滴定法研究了四苯基卟啉对 4-(咪唑-1-基)-苯酚的结合能力, 确定了所得配合物的稳定性常数及其存在的浓度区间。
• Synthesis of ms- and β-substituted ruthenium(II) porphyrinates
  作者：N. V. Chizhova、R. S. Kumeev、N. Zh. Mamardashvili

  DOI：10.1134/s0036023610090147

  日期：2010.9

  The reactions of 5,10,15,20-tetraphenylporphine, 2,3,7,8,12,13,17,18-octaethylporphine, and tetra(4-methoxyphenyl)porphine with Ru(3)(CO)(12) in boiling phenol were studied by spectrophotometry. The following compounds were synthesized and identified: Ru(2+)(CO)(H(2)O) 5,10,15,20-tetraphenylporphyriate, Ru(2+)(CO)(H(2)O) 2,3,7,8,12,13,17,18-octaethylporphyrinate, Ru(2+)(CO)(Py) 2,3,7,8,12,13,17,18-octaethylporphyrinate, and Ru(2+)(CO)(H(2)O)tetra(4-methoxyphenyl) porphyrinate. The strong electronic effect of the substituents on the reactivity of the tetrapyrrole cycle during the formation of the corresponding porphyrinates was established.
• Synthetic and Mechanistic Aspects of a New Method for Ruthenium-Metalation of Porphyrins and Schiff-Bases
  作者：Júlio S. Rebouças、Elizabeth L. S. Cheu、Caroline J. Ware、Brian R. James、Kirsten A. Skov

  DOI：10.1021/ic800616q

  日期：2008.9.1

  A new method is presented for metalation of a wide range of free-base, neutral, cationic, and anionic porphyrins in refluxing dimethylformamide (DMF) using an easily prepared [Ru(DMF)(6)](OTf)(3) complex, and comparisons are made with the more familiar metalation procedure using Ru-3(CO)(12). Both procedures generate Ru-II(porp)(CO)L complexes (L = solvent); use of the Ru-III-triflate precursor gives yields comparable to, or greater than, those obtained with the carbonyl, and generates no Ru-chlorin impurities. Mechanistic studies on the meso-tetraphenylporphyrin system reveal that the DMF furnishes the CO, which in the presence of essential water reduces the metal, and metalation likely occurs via a Ru-II-CO species. Corresponding metalation of tetradentate Schiff-bases gives trans-[Ru-III(Schiff-base)(DMF)(2)]OTf complexes in yields of similar to 50%, a limitation being the accompanying hydrolysis of the Schiff-base through the presence of trace water.