[(HC(CMeN-2,6-(i-Pr)2C6H3)2)Al(μ-Se)2Zr(C5H5)2] | 947408-65-3

• 英文名称: [(HC(CMeN-2,6-(i-Pr)2C6H3)2)Al(μ-Se)2Zr(C5H5)2]
• CAS: 947408-65-3
• 化学式: C₃₉H₅₁AlN₂Se₂Zr
• 分子量: 823.973
• InChiKey: PCRFUXBLMNPUOJ-WNNZKXAMSA-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：

  二氯二茂锆 、 [(HC(CMeN-2,6-(i-Pr)2C6H3)2)Al(SeLi)2(THF)2] 以 四氢呋喃 为溶剂， 以88%的产率得到[(HC(CMeN-2,6-(i-Pr)2C6H3)2)Al(μ-Se)2Zr(C5H5)2]
  参考文献：
  名称：

  Synthesis and Characterization of Well-Defined Aluminum-Containing Heterobimetallic Selenides

  摘要：

  A series of novel aluminum heterobimetallic selenicles were reported. The reaction of LAI(SeH)(2) (1) with LiN(SiMe3)(2) resulted in the formation of [LAI(SeLi)(2)(THF)(2)] (2) (L = HC(CMeNAr)(2), Ar = 2,6-iPr(2)C(6)H(3))- Compound 2 reacted with Me2GeCl2, Ph2GeCl2, CP2TiCl2, and CP2ZrCl2, respectively, to produce LAI(mu-Se)(2)GeMe2 (3), LAI(mu-Se)(2)GePh2 (4), LAI(mu-Se)(2)TiCP2 (5), and LAI(mu-Se)(2)ZrCp2 (6) in moderate yields. Compounds 2-6 were characterized by elemental analysis, NMR, and electron impact-MS. The X-ray single-crystal structure of 3 is reported and confirms the spirocyclic arrangement of the aluminum atom within the six-membered AlN2C3 and four-membered AlSe2Ge rings.

  DOI：

  10.1021/ic700945a