[(N(CH2CH2NSiMe3)3)ZrMe] | 937801-05-3

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: [(N(CH2CH2NSiMe3)3)ZrMe]
• 英文别名: (N(CH2CH2NSiMe3)3)ZrMe；2-[bis(2-trimethylsilylazanidylethyl)amino]ethyl-trimethylsilylazanide;carbanide;zirconium(4+)
• CAS: 937801-05-3
• 化学式: C₁₆H₄₂N₄Si₃Zr
• 分子量: 466.017
• InChiKey: SIFQSONEWJGZIV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.36
• 重原子数：
  24
• 可旋转键数：
  12
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  6.2
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  [(N(CH2CH2NSiMe3)3)ZrMe] 以 苯 为溶剂， 以47%的产率得到[κ⁵-N,N,N,N,C-(Me₃SiNCH₂CH₂)₂NCH₂CH₂NSiMe₂CH₂]Zr
  参考文献：
  名称：

  Selective Dehydrocoupling of Phosphines by Triamidoamine Zirconium Catalysts

  摘要：

  New zirconium triamidoamine complexes (N3N)ZrR (N3N = N(CH2CH2NSiMe3)(3)(3-); R = Me, < BO > 1 ; PHPh, < BO > 2 ; PHCy, < BO > 4) are effective catalysts for the dehydrocoupling of primary and secondary phosphines and select for the diphosphine product. Mechanistic analysis revealed that metal-catalyzed P-P bond formation occurs via sigma-bond metathesis steps.

  DOI：

  10.1021/om070189o
• 作为产物：
  描述：

  (N₃N)ZrCl 、 甲基锂 以 乙醚 为溶剂， 以82%的产率得到[(N(CH2CH2NSiMe3)3)ZrMe]
  参考文献：
  名称：

  Selective Dehydrocoupling of Phosphines by Triamidoamine Zirconium Catalysts

  摘要：

  New zirconium triamidoamine complexes (N3N)ZrR (N3N = N(CH2CH2NSiMe3)(3)(3-); R = Me, < BO > 1 ; PHPh, < BO > 2 ; PHCy, < BO > 4) are effective catalysts for the dehydrocoupling of primary and secondary phosphines and select for the diphosphine product. Mechanistic analysis revealed that metal-catalyzed P-P bond formation occurs via sigma-bond metathesis steps.

  DOI：

  10.1021/om070189o

文献信息

• Zirconium-Catalyzed Heterodehydrocoupling of Primary Phosphines with Silanes and Germanes
  作者：Andrew J. Roering、Samantha N. MacMillan、Joseph M. Tanski、Rory Waterman

  DOI：10.1021/ic7013144

  日期：2007.8.1

  Triamidoamine-supported zirconium complexes catalyze the heterodehydrocoupling of primary phosphines with silane and germanes. In this catalysis, P-Si or P-Ge products are observed exclusively with no competitive P-P bond formation. Phosphido complexes (N3N)ZrPHR (N3N = N(CH2CH2NSiMe3)33-, R = Ph, 2; Cy, 3) were observed to be the catalyst resting state, and complex 2 was structurally characterized

  三酰氨基胺负载的锆络合物催化伯膦与硅烷和锗烷的杂脱氢偶联。在这种催化中，仅观察到P-Si或P-Ge产物，没有竞争性的PP键形成。观察到磷酸盐配合物（N 3 N）ZrPHR（N 3 N ＝ N（CH 2 CH 2 NS 1 Me 3）33-，R ＝ Ph，2； Cy，3）为催化剂静止状态，并且对配合物2进行了结构表征。
• C–N Bond formation via ligand-induced nucleophilicity at a coordinated triamidoamine ligand
  作者：Annalese F. Maddox、Karla A. Erickson、Joseph M. Tanski、Rory Waterman

  DOI：10.1039/c1cc15179g

  日期：——

  Reaction of (N3N)ZrX complexes (X = amido, Cl−, CH3−) with carbodiimide substrates results in insertion into an Zr–N bond of the triamidoamine ligand rather than the Zr–X bond as has been observed for related (N3N)ZrX complexes (X = PR2−, AsR2−).

  (N3N)ZrX 复合物（X = 氨基、Clâ、CH3â）与碳化二亚胺底物反应时，会插入三氨基胺配体的 ZrâN 键，而不是 ZrâX 键，这一点在相关的 (N3N)ZrX 复合物（X = PR2â、AsR2â）中也有观察到。