and references therein) to make a detailed calculation of the rovibronic energies in the first excited electronic state, Ã 2 , of the MgNC radical. This calculation is based on ab initio data (supplemented here with points for larger bending displacements from linearity) calculated at the level of M
The C–N Stretching Vibronic Bands of the MgNC Ã2Π–X̃2Σ+ Transition
✍ Scribed by Masaru Fukushima; Takashi Ishiwata
- Publisher
- Elsevier Science
- Year
- 2002
- Tongue
- English
- Weight
- 141 KB
- Volume
- 216
- Category
- Article
- ISSN
- 0022-2852
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✦ Synopsis
We have generated MgNC in supersonic free jet expansions and measured the laser-induced fluorescence excitation spectra of the C-N stretching vibronic bands of the à 2 -X 2 + transition. Rotational analysis yields the molecular constants of the vibronic levels, (1,0,0) and (1,0,1), in the à 2 state. We cannot find any anomalies in the constants of these vibronic levels, while they are predicted to lie above the barrier of the isomerization reaction pathway, MgNC ↔ MgCN, on the à 2 state. On the basis of the molecular constants obtained, we discuss the fine structures of both the ground X 2 + and excited à 2 states.
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