8-iodo-4-methyloctahydro-8l5-[1,2]azabismolo[1,2-a][1,2]azabismol-4-ium | 155264-96-3

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机含氧阴离子化合物
• 英文名称: 8-iodo-4-methyloctahydro-8l5-[1,2]azabismolo[1,2-a][1,2]azabismol-4-ium
• CAS: 155264-96-3
• 化学式: C₇H₁₅BiIN
• 分子量: 449.088
• InChiKey: SYSVEJAGYIYOHH-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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：

  碘化铋 、 3,3'-methyliminobis(propylmagnesiumchloride) 以 四氢呋喃 、 甲苯 为溶剂， 以11%的产率得到8-iodo-4-methyloctahydro-8l5-[1,2]azabismolo[1,2-a][1,2]azabismol-4-ium
  参考文献：
  名称：

  On heterocyclic systems containing bismuth(III) 2. Eight-membered heterocycles Cl/Br/I-M(CH2CH2CH2)2X with lewis acidic group 15 atoms M  As, Sb, Bi and donor atoms X  NR, S: a contribution to the value of the electronegativity of bismuth(III)

  摘要：

  Paths to the ligands (Cl/Br-CH2CH2CH2)(2)NR/O/S/Se, R = Me, Bz, iPr, iBu, to the diGrignard reagents (Cl/BrMg-CH2CH2CH2)(2)NR/O/S, R = Me, Bz, iPr, iBu and to the eight-membered group 15 heterocycles (C1/Br/I-As/Sb/Bi(CH2CH2CH2)(2)NR/S, R = Me, Bz, iBu are given. C-13-NMR, TR and Raman spectra are discussed; for the compound ClSb(CH2CH2CH2)(2)NMe the crystal structure analysis is given: the antimony atom is clearly Lewis acidic with psi-trigonal-bipyramidal coordination and a transannular Sb ... N interaction of 2.385(2) Angstrom. For such a configuration the values of the C-13-NMR chemical shifts of the alpha-CH2-groups (e.g. Cl-As/Sb/Bi(alpha CH2CH2CH2)(2)NMe 34.6, 25.9, 46.6 ppm) display clearly a sequence N > Bi > P approximate to As > Sb for the Paulins electronegativities of the group 15 elements: a value as high as 2.3 for bismuth is suggested.

  DOI：

  10.1016/s0277-5387(00)81647-2