1,3-(N,N-bis(trimethylsiyl)amino)diarsa-2,4-(N-trimethylsilyl)diazan | 57212-53-0

• 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: 1,3-(N,N-bis(trimethylsiyl)amino)diarsa-2,4-(N-trimethylsilyl)diazan
• 英文别名: 2-N,2-N,4-N,4-N,1,3-hexakis(trimethylsilyl)-1,3,2,4-diazadiarsetidine-2,4-diamine
• CAS: 57212-53-0
• 化学式: C₁₈H₅₄As₂N₄Si₆
• 分子量: 645.01
• InChiKey: ZBJRSVJEFCMZMO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.19
• 重原子数：
  30
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  13
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  bischloroarsenic 在 silver trifluoromethanesulfonate 作用下， 以 二氯甲烷 为溶剂， 反应 2.0h， 以95%的产率得到1,3-(N,N-bis(trimethylsiyl)amino)diarsa-2,4-(N-trimethylsilyl)diazan
  参考文献：
  名称：

  Structure and Bonding of Novel Acyclic Bisaminoarsenium Cations

  摘要：

  The synthesis and characterization of a salt bearing a labile bisaminoarsenium cation of the type {[(Me3Si)(2)N](2)As}(+) (9a) are described, which was obtained in the reaction of the chloroarsane [(Me3Si)(2)N](2)AsCl (8) with GaCl3. Reacting 8 with AgOTf did not yield an arsenium salt, but the cyclo-diarsadiazane [(Me3Si)(2)NAs-mu-NSiMe3](2) (11) was obtained in excellent yields. Moreover, the reactivity of the analogous antimony species [(Me3Si)(2)N](2)SbCl (12) was studied. In the reaction with GaCl3, the aminochlorostibenium salt [(Me3Si)(2)NSbCl](+)[(Me3Si)(2)N(GaCl3)(2)](-) (5) was isolated. In the reaction with AgOTf, substitution of the chlorine in 12 resulted in the formation of [(Me3Si)(2)N](2)SbOTf (13), a compound with significant stibenium character. All new compounds have been fully characterized by means of X-ray, vibrational spectroscopy, CHN analysis, and NMR experiments. All compounds were further investigated by means of density functional theory and the bonding situation was accessed by natural bond orbital (NBO) analysis.

  DOI：

  10.1021/ic4010104

文献信息

• Structure and Bonding of Novel Acyclic Bisaminoarsenium Cations
  作者：Christian Hering、Julia Rothe、Axel Schulz、Alexander Villinger

  DOI：10.1021/ic4010104

  日期：2013.7.1

  The synthesis and characterization of a salt bearing a labile bisaminoarsenium cation of the type [(Me3Si)(2)N](2)As}(+) (9a) are described, which was obtained in the reaction of the chloroarsane [(Me3Si)(2)N](2)AsCl (8) with GaCl3. Reacting 8 with AgOTf did not yield an arsenium salt, but the cyclo-diarsadiazane [(Me3Si)(2)NAs-mu-NSiMe3](2) (11) was obtained in excellent yields. Moreover, the reactivity of the analogous antimony species [(Me3Si)(2)N](2)SbCl (12) was studied. In the reaction with GaCl3, the aminochlorostibenium salt [(Me3Si)(2)NSbCl](+)[(Me3Si)(2)N(GaCl3)(2)](-) (5) was isolated. In the reaction with AgOTf, substitution of the chlorine in 12 resulted in the formation of [(Me3Si)(2)N](2)SbOTf (13), a compound with significant stibenium character. All new compounds have been fully characterized by means of X-ray, vibrational spectroscopy, CHN analysis, and NMR experiments. All compounds were further investigated by means of density functional theory and the bonding situation was accessed by natural bond orbital (NBO) analysis.