[Ti(η5-C5H4SiMe2-η-N(CH2)2NH2)Cl2] | 437713-75-2

• 英文名称: [Ti(η5-C5H4SiMe2-η-N(CH2)2NH2)Cl2]
• 英文别名: Ti(η5-C5H4SiMe2-η-N(CH2)2NH2)Cl2
• CAS: 437713-75-2
• 化学式: C₉H₁₆Cl₂N₂SiTi
• 分子量: 299.111
• InChiKey: VPKQLIDIHQRFQC-UHFFFAOYSA-L

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：

  (η5-trimethylsilylcyclopentadienyl)niobium tetrachloride 、 [Ti(η5-C5H4SiMe2-η-N(CH2)2NH2)Cl2] 以 氘代苯 为溶剂， 生成 [TiCl2(η5-C5H4SiMe2-η-N(CH2)2-κ-NH2)Nb(η5-trimethylsilylcyclopentadienyl)Cl4]
  参考文献：
  名称：

  带有金属-氮键的铌和钽配合物的合成，表征和反应性。的透视分子结构[Nb的（C 5 ħ 4森达3）{NH（CH 2）2 -η-NH 2 }氯3 ]与小说四核铌氧代衍生物[{的Nb（C 5 H ^ 4森达3）氯（μ 2 -O）} 4（CL）2（μ 3 -O）]

  摘要：

  环戊二烯基甲硅烷基酰氨基钛化合物的反应钛[Ti {η 5 -C 5 H ^ 4森达2 -η-N（CH 2）2 -η-NH 2 }氯2 ]与第5种族金属的单环戊二烯配合物[MCP ř CL 4 ];（M =铌，钽的Cp - [R = C 5 H ^ 4森达3（CP'），C 5我5，得到（CP *））双核配合物[的TiCl 2 {η 5 -C 5 H ^ 4森达2 -η-N（CH 2）2 -κ-NH 2 } MCP ř氯4 ]（M =铌中，Cp [R = CP ' 2a中; *的Cp，2B ; M =钽中，Cp [R = CP'，3A ; CP =的Cp *，3B） 。化合物2演变在室温下，得到的三组分混合物中，氯甲硅烷取代的环戊二烯钛化合物钛[Ti（η 5 -C 5 H ^ 4森达2 Cl）的氯3 ]，相应的单核酰氨基-氨基，[国家预防腐败局ř { NH（CH 2）2 -η-NH 2 }氯3

  DOI：

  10.1021/om7002927
• 作为产物：
  描述：

  Ti(η(5)-C5H4SiMe2Cl)Cl3 、 乙二胺 在 NEt₃ 作用下， 以 甲苯 为溶剂， 以65.2%的产率得到[Ti(η5-C5H4SiMe2-η-N(CH2)2NH2)Cl2]
  参考文献：
  名称：

  Cyclopentadienyl-Amido Ligands with a Pendant “−NHR” Amino Functionality in Titanium Chemistry. Molecular Structure of [Ti{η⁵-C₅H₄SiMe₂-η-N(CH₂)₂-η-NHCHMe₂}Cl₂]

  摘要：

  The reaction of the chlorodimethylsilyl-substituted cyclopentadienyl titanium compound [Ti(eta(5)-C5H4SiMe2Cl)Cl-3] (1) with 1 equiv of NH2(CH2)(2)NHR (R = H, CHMe2), in the presence of 2 equiv of NEt3, afforded the mononuclear complexes [Ti{eta(5)-C5H4SiMe2-eta-N(CH2)(2)-eta-NHR}Cl-2] (R = H, 2; CHMe2, 3) in high yield. While 2 is stable in solution, 3 slowly evolves into the strain-free complex [Ti{eta(5)-C5H4SiMe2NH(CH2)(2)-eta-NCHMe2}Cl-2] (4). 1 reacts with 0.5 equiv of ethylenediamine to yield a mixture of 2 and the dinuclear titanium complex [Ti{eta(5)-C5H4SiMe2-eta-N(CH2)-}Cl-2](2) (5), which contains two tethered cyclopentadienyl-silyl-amido fragments. Compound 5 is also obtained from the reaction of 2 with 1. Treatment of 1 with 0.5 equiv of propylenediamine rendered the dinuclear compound [Ti{eta(5)-C5H4SiMe2-N(CH2)(1.5)-}Cl-2](2) (6), whereas a mixture of 6 and the mononuclear species-[Ti{eta(5)-C5H4SiMe2-eta-N(CH2)(3)NH2}Cl-2] (7) was spectroscopically observed when 1 was reacted with 1 equiv of NH2(CH2)(3)NH2 in C6D6. A similar reaction of 1 with N-methylpropylenediamine regioselectively affords the unstrained mononuclear compound [Ti{eta(5)-C5H4SiMe2NH(CH2)(3)-eta-NMe}Cl-2] (8). Dinuclear derivatives [Ti{eta(5)-C5H4SiMe2-eta-N(CH2)(x)-}Cl-2](2) (x = 2 (9); 2.5 (10)) were prepared by reacting complex 1 with butylenediamine and pentylenediamine, respectively. These compounds were characterized by elemental analysis and NMR spectroscopy. The crystal structure of 3 was determined by X-ray diffraction methods.

  DOI：

  10.1021/om0110890

文献信息

• Cyclopentadienyl-Silyl-Amido Niobium Complexes Prepared by a Transmetalation Reaction Using Ti{η⁵-C₅H₄SiMe₂-η-N(CH₂)₂NRR‘}Cl₂
  作者：M. Carmen Maestre、Vanessa Tabernero、Marta E. G. Mosquera、Gerardo Jiménez、Tomás Cuenca

  DOI：10.1021/om0505312

  日期：2005.11.1

  Reaction of Tieta(5)-C5H4SiMe2-eta-N(CH2)(2)NRR'}Cl-2 with Nb(eta(5)-C5H4SiMe2Cl)Cl-4 affords the tethered heterodinuclear complexes TiCl2eta(5)-C5H4SiMe2-eta-N(CH2)(2)-K-NRR'}Nb(eta(5)-C5H4SiMe2-Cl)Cl-4, which are thermally unstable in solution and evolve to render an equimolar mixture of Ti(eta(5)-C5H4SiMe2Cl)Cl-3 and the corresponding cyclopentadienyl-amido niobium compounds, Nbeta(5)-C5H4SiMe2-eta-N(CH2)(2)NRR'}Cl-3. These compounds are straightforwardly obtained from the reaction of Nb(eta(5)-C5H4SiMe2Cl)Cl-4 with 1 equiv of the appropriate diamine, NH2(CH2),-NRR', in the presence of 2 equiv of NEt3, in high yield. In this reaction, the presence of the functional pendant chain plays a central role not only in determining the course of the reaction but also in stabilizing the final product, from both an electronic and a steric point of view. The molecular structure of Nbeta(5)-C5H4SiMe2-eta-N(CH2)(3)-eta-NH2]Cl-3 has been determined by X-ray diffraction methods.