carbon-13C dioxide-18O compound with helium (1:1) | 915202-24-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: carbon-13C dioxide-18O compound with helium (1:1)
• CAS: 915202-24-3
• 化学式: CO₂*He
• 分子量: 53.0026
• InChiKey: RFXQKWLYZGJSHE-SORTUTTKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.58
• 重原子数：
  4.0
• 可旋转键数：
  0.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  34.14
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为产物：
  描述：

  氦气 、 二氧化碳(13C;18O2) 以 gas 为溶剂， 生成 carbon-13C dioxide-18O compound with helium (1:1)
  参考文献：
  名称：

  Fourier transform microwave spectra of the very weakly bound He–CO 2 dimer

  摘要：

  Spectra of pure rotational transitions of the very weakly bound He-CO2 van der Waals complex were investigated using a pulsed molecular beam Fourier Transform microwave spectrometer. The complex exhibits very large amplitude internal vibrational motions and the rotational transitions were, as a consequence, difficult to locate and to assign. Eight isotopomers, namely He-CO2, He-(CO2)-C-13, He-(OCO)-O-18, He-(OCO)-C-13-O-18, He-(OCO)-O-18-O-18, He-(OCO)-O-18-C-13-O-18, He-(OCO)-O-17, and He-(OCO)-C-13-O-17, Were studied in order to establish the assignments. The hyperfine structures due to the quadrupolar O-17 nucleus were resolved and analyzed in the two O-17 containing isotopomers. The observed nuclear quadrupole hyperfine structures not only provide further confirmation for the assignment but also give new information about the angular anisotropy of the He-CO2 interaction potential. (C) 2001 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0022-2860(01)00853-5