Aluminum;krypton

• 分子结构分类: 无机化合物 - 混合金属/非金属化合物 - 各种混合金属/非金属
• 英文名称: Aluminum;krypton
• 英文别名: aluminum;krypton
• 化学式: AlKr
• 分子量: 110.782
• InChiKey: WUEBFVJHPWVQIU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.38
• 重原子数：
  2
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.0
• 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：

  氪气 、 氢化铝 以 neat (no solvent) 为溶剂， 生成 Aluminum;krypton
  参考文献：
  名称：

  Spectroscopic characterization of the X ²Π_1/2, B ²Σ_1/2, and H ²Σ_1/2 states of AlKr

  摘要：

  The AlKr van der Waals complex was characterized by laser-induced fluorescence spectroscopy in a supersonic free jet. Rotationally resolved spectra were recorded for eight bands of the AlKr(B 2Σ+←X 2Π1/2) transition and for seven bands of the AlKr(H 2Σ+←X 2Π1/2) transition. Rydberg–Klein–Rees potential-energy curves were determined for the B 2Σ+ and H 2Σ+ states, using vibrational and rotational spectroscopic constants derived from the spectra. The interaction between the X 2Π1/2 ground state and the low-lying repulsive A 2Σ+ state was characterized by analysis of the Λ doubling in the ground state. Equilibrium bond lengths were obtained for the X, B, and H states, and dissociation energies for the B and H states. The fact that the more strongly bound H 2Σ+ state has a larger re value than the B 2Σ+ state was rationalized by postulating an avoided potential curve crossing between the H 2Σ+ state and a repulsive valence 2Σ+ state correlating with Al(3s23d)+Kr.

  DOI：

  10.1063/1.463156

文献信息

• Spectroscopic characterization of the <i>X</i> ²Π₁_/₂, <i>B</i> ²Σ_1/2, and <i>H</i> ²Σ_1/2 states of AlKr
  作者：Zhenwen Fu、Steven Massick、John G. Kaup、Odile Benoist d’Azy、W. H. Breckenridge

  DOI：10.1063/1.463156

  日期：1992.8

  The AlKr van der Waals complex was characterized by laser-induced fluorescence spectroscopy in a supersonic free jet. Rotationally resolved spectra were recorded for eight bands of the AlKr(B 2Σ+←X 2Π1/2) transition and for seven bands of the AlKr(H 2Σ+←X 2Π1/2) transition. Rydberg–Klein–Rees potential-energy curves were determined for the B 2Σ+ and H 2Σ+ states, using vibrational and rotational spectroscopic constants derived from the spectra. The interaction between the X 2Π1/2 ground state and the low-lying repulsive A 2Σ+ state was characterized by analysis of the Λ doubling in the ground state. Equilibrium bond lengths were obtained for the X, B, and H states, and dissociation energies for the B and H states. The fact that the more strongly bound H 2Σ+ state has a larger re value than the B 2Σ+ state was rationalized by postulating an avoided potential curve crossing between the H 2Σ+ state and a repulsive valence 2Σ+ state correlating with Al(3s23d)+Kr.