trans-[RuIII(H2O)(NH3)4(P(OEt)3)]3+ | 112812-92-7

• 分子结构分类: 有机化合物 - 有机磷化合物
• 英文名称: trans-[RuIII(H2O)(NH3)4(P(OEt)3)]3+
• 英文别名: trans-{Ru(NH3)4(triethyl phosphite)(H2O)}(3+)；trans-[Ru^III(H₂O)(NH₃)₄(P(OEt)₃)]³⁺；trans-[Ru(H2O)(NH₃)₄(P(OEt)₃)]³⁺；trans-[Ru(NH3)4P(OEt)3H2O](3+)
• CAS: 112812-92-7
• 化学式: C₆H₂₉N₄O₄PRu
• 分子量: 353.364
• InChiKey: VHJHHNYGVSXJST-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

• 作为反应物：
  描述：

  trans-[RuIII(H2O)(NH3)4(P(OEt)3)]3+ 在 H⁽¹⁺⁾ 、 CF₃COONa 作用下， 以 水 为溶剂， 以>99的产率得到trans-[RuII(H2O)(NH3)4(POEt)3]2+
  参考文献：
  名称：

  Triethyl phosphite as a ligand on Ru(III). Synthesis, characterization and properties of trans-[Ru(NH3)4P(OEt)3(H2O)](CF3SO3)3

  摘要：

  The complex ion trans-[Ru(NH3)4P(OEt)3(H2O)]3+ was obtained through electrochemical and chemical oxidation of the corresponding Ru(II) complex ion. The compound trans-[Ru(NH3)4P(OEt)3(H2O)]-(CF3SO3)3 was isolated and characterized by means of micro-analysis, cyclic voltammetry, UV-Vis and electron paramagnetic resonance spectroscopy. The ion trans[Ru(NH3)4P(OEt)3(H2O)]3+ decomposes in aqueous solution according to 4Ru(III) double-line-arrow-pointing-right 3Ru(II) + Ru(VI). The decay rate of the Ru(III) complex ion concentration is inversely proportional to the hydrogen ion solution concentration (C(H+) = 1.0 x 10(-1) M, k(obs) = 4 x 10(-5) S-1; C(H+) = 10(-12) M, k(obs) = 3.3 S-1; 25-degrees-C, mu = 0.3 NaCF3COO).

  DOI：

  10.1016/s0020-1693(00)85191-9
• 作为产物：
  描述：

  以 水 为溶剂， 生成 trans-[RuIII(H2O)(NH3)4(P(OEt)3)]3+
  参考文献：
  名称：

  On the reaction of carbon monoxide with the complexes trans-[Ru(NH3)4P(OEt)3(H2O)]2+ and trans-[Ru(NH3)4PPh3(H2O)]2+

  摘要：

  DOI：

  10.1016/s0020-1693(00)88093-7

文献信息

• Unexpected NO Transfer Reaction between <i>trans</i>-[Ru^II(NO⁺)(NH₃)₄(L)]³⁺ and Fe(III) Species: Observation of a Heterobimetallic NO-Bridged Intermediate
  作者：Gustavo Metzker、Pietro P. Lopes、Augusto C. H. da Silva、Sebastiao C. da Silva、Douglas W. Franco

  DOI：10.1021/ic500122b

  日期：2014.5.5

  )4(L)]3+, L = ImN, IsN, Nic, P(OMe)3, P(OEt)3, and P(OH)(OEt)2, and the Fe(III) species [FeIII(TPPS)], metmyoglobin, and hemoglobin was monitored by UV–vis, EPR, and electrochemical techniques (DPV, CV). No reaction was observed when L = ImN, IsN, Nic, and P(OH)(OEt)2. However, when L = P(OMe)3 and P(OEt)3, the reaction was quantitative and the products were trans-[RuIII(H2O)(NH3)4(P(OR)3)]3+ and [FeII(NO+)]

  之间的反应的反式的[Ru - II（NO +）（NH 3）4（L）] 3+，L = IMN，ISN，NIC，P（OME）3，P（OET）3，和P（OH）（ OEt）2和Fe（III）物种[Fe III（TPPS）]，肌红蛋白和血红蛋白通过UV-vis，EPR和电化学技术（DPV，CV）进行监测。当L ＝ ImN，IsN，Nic和P（OH）（OEt）2时，未观察到反应。但是，当L = P（OMe）3和P（OEt）3时，反应是定量的，产物是反式-[Ru III（H 2 O）（NH 3）3）4（P（OR）3）] 3+和[Fe II（NO +）]物种。反应动力学数据和DFT计算表明，有一个两步反应机理，即初步形成了桥接的[Ru-（μNO）-Fe]中间体，该中间体已通过电化学技术证实（E 0 '= -0.47 V vs NHE）。该反应的具体的计算速率常数值在范围ķ 1 = 1.1〜7.71摩尔-1小号-1和ķ