| 1195301-93-9

• CAS: 1195301-93-9
• 化学式: C₇₅H₁₃NS₃
• 分子量: 1024.13
• InChiKey: CMLQXOTUOZCPQX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  2,2':5',2'-四噻吩-5-甲醛 、 肌氨酸 、 足球烯 以 邻二氯苯 为溶剂， 反应 48.0h， 以33%的产率得到
  参考文献：
  名称：

  Vibrational spectroscopy as a tool for characterization of oligothiophene–fullerene linked dyads

  摘要：

  The set of three oligothiophenes covalently linked to fullerene was investigated using Raman scattering and the infrared absorption spectroscopies. Additionally, the quantum chemical calculations of the equilibrium geometry and normal mode vibrations of the dyads were performed. It was shown that vibrational spectroscopy can be successfully used for characterization of such complex molecular systems. It was stated that infrared spectra in the region 700-900 cm (1) act as fingerprints for the investigated dyads. (c) 2009 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.cplett.2009.08.030