1,4,11,15,30-pentakis(phenyldimethylsilylmethyl)-2H-1,2,4,11,15,30-hexahydro[60]fullerene

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 1,4,11,15,30-pentakis(phenyldimethylsilylmethyl)-2H-1,2,4,11,15,30-hexahydro[60]fullerene
• 英文别名: dimethyl-phenyl-[[7,11,24,27-tetrakis[[dimethyl(phenyl)silyl]methyl]-8H-(C60-Ih)[5,6]fulleren-1-yl]methyl]silane
• 化学式: C₁₀₅H₆₆Si₅
• 分子量: 1468.11
• InChiKey: BEZBVJKBQZLHEV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  23.98
• 重原子数：
  110
• 可旋转键数：
  15
• 环数：
  37.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  magnesium,methanidyl-dimethyl-phenylsilane,chloride 、 足球烯 在 1,3-二甲基-2-咪唑啉酮 、 copper(I) bromide dimethylsulfide complex 作用下， 以 四氢呋喃 、 邻二氯苯 为溶剂， 反应 1.0h， 以25%的产率得到1,4,11,15,30-pentakis(phenyldimethylsilylmethyl)-2H-1,2,4,11,15,30-hexahydro[60]fullerene
  参考文献：
  名称：

  Stacking of Molecules Possessing a Fullerene Apex and a Cup-Shaped Cavity Connected by a Silicon Connection

  摘要：

  Hexagonal or tetragonal packing of columnar stacks in crystals and liquid crystals has been observed for a series of molecules possessing a fullerene apex and an aromatic cone that are connected with a Si-C connection. The columnar stacking of the new shuttlecock molecules is constitutionally stable but conformationally flexible due to the large cavity created on the top of the fullerene molecule.

  DOI：

  10.1021/ja038816y

文献信息

• Stacking of Molecules Possessing a Fullerene Apex and a Cup-Shaped Cavity Connected by a Silicon Connection
  作者：Yutaka Matsuo、Ayako Muramatsu、Ryo Hamasaki、Norihiro Mizoshita、Takashi Kato、Eiichi Nakamura

  DOI：10.1021/ja038816y

  日期：2004.1.1

  Hexagonal or tetragonal packing of columnar stacks in crystals and liquid crystals has been observed for a series of molecules possessing a fullerene apex and an aromatic cone that are connected with a Si-C connection. The columnar stacking of the new shuttlecock molecules is constitutionally stable but conformationally flexible due to the large cavity created on the top of the fullerene molecule.