[In(CH3)(N,N'-diisopropylaminotroponiminate)(P(CH3)3)][B(C6F5)4] | 412914-80-8

• 英文名称: [In(CH3)(N,N'-diisopropylaminotroponiminate)(P(CH3)3)][B(C6F5)4]
• CAS: 412914-80-8
• 化学式: C₁₇H₃₁InN₂P*C₂₄BF₂₀
• 分子量: 1088.28
• InChiKey: NAFQKXVOJSWWJS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  1-isopropylamino-7-isopropylimino-1,3,5-cycloheptatriene 以 正己烷 、 氯苯 、 正戊烷 为溶剂， 生成 [In(CH3)(N,N'-diisopropylaminotroponiminate)(P(CH3)3)][B(C6F5)4]
  参考文献：
  名称：

  Cationic Indium Alkyl Complexes Incorporating Aminotroponiminate Ligands

  摘要：

  The synthesis and structures of indium complexes incorporating the bidentate monoanionic ligand N,N'-diisopropylaminotroponiminate (Pr-i(2)-ATI) are described. The reaction of InCl3 with Li[Pr-i(2)-ATI] yields (Pr-i(2)-ATI)InCl2 (3), which is converted to (Pr-i(2)-ATI)InMe2 (4) by reaction with MeLi; 4 is also formed by the reaction of InMe3 with (Pr-i(2)-ATI)H. The reaction of 4 with [Ph3C] [B(C6F5)(4)] at 23 degreesC yields the diimine complex [{1,2-((NPr)-Pr-i)(2)-5-CPh3-cyclohepta-3,6-diene}InMe2] [B(C6F5)(4)] (5) via addition of Ph3C+ to the C5 carbon of 4. Thermolysis of 5 (75 degreesC) yields [(Pr-i(2)-ATI)InMe] [B(C6F5)(4)] (6) and Ph3CMe. 43 was isolated as the chlorobenzene solvate 6.PhCl. An X-ray diffraction study shows that there are two independent cations in the asymmetric unit of 6.PhCl. One cation (In(1)) is ion-paired with two B(C6F5)(4)(-) anions, while the second cation is complexed with two PhCl molecules and is disordered between two equally occupied positions (In(2) and In(3)). Dative In-ClPh bonding and PhCl/ATI pi-stacking interactions contribute to the PhCl coordination in 6.PhCl. The reaction of 4 with B(C6F5)(3) yields [(Pr-i(2)-ATI)InMe] [MeB(C6F5)(3)] (7), which decomposes slowly at 23 degreesC by C6F5- transfer reactions. The reaction of 4 with [HNMe2Ph] [B(C6F5)(4)] yields the labile amine adduct [(Pr-i(2)-ATI)In(Me)(NMe2Ph)][B(C6F5)(4)] (10).

  DOI：

  10.1021/om010578x