| 148336-86-1

• CAS: 148336-86-1
• 化学式: Ar*CHN
• 分子量: 66.9736
• InChiKey: AIPLALGIEZLGBI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.14
• 重原子数：
  3.0
• 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：
  23.79
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为产物：
  描述：

  氢氰酸 、 氩 以 neat (no solvent, gas phase) 为溶剂， 生成
  参考文献：
  名称：

  Direct absorption observation of the van der Waals bending band of ArHCN by millimeterwave spectroscopy combined with pulsed‐jet expansion technique

  摘要：

  Millimeterwave absorption spectroscopy combined with the pulsed-jet expansion technique was applied to the measurement of rovibrational transitions in the van der Waals band of ArHCN near 200 GHz. Observations were extended to the higher millimeterwave frequency region up to 260 GHz, and 17 rovibrational transitions split into hyperfine components due to the nitrogen nucleus were newly observed for both the Σ1–Σ0 and Π1–Σ0 bands. An improved set of molecular constants, including the band origins, rotational constants, quadrupole coupling constants, and the Coriolis coupling constant between the Σ1 and Π1 bending substrates, was determined.

  DOI：

  10.1063/1.471736