- Type
- absorption
- Assignments summary
- Characteristics summary
| Assignment | Symmetry | Mode | Specie(s) | Molecule/Atom | Bond | Multiplicity | Degeneracy | Contribution | Resonance |
|---|---|---|---|---|---|---|---|---|---|
| ν7+ν8 | unknown | combination vibration | CH3CN | CH3CN | -C ≤ H3 | unknown | Fermi resonance |
| Peak position (cm-1) |
Center position (cm-1) |
Width (cm-1) |
Shape | Asymmetry factor | Peak intensity (cm-1) |
Peak intensity relative | Peak strength | Integrated intensity (cm-2) |
Integrated intensity relative | Integrated strength | Temperature (K) |
Pressure (bar) |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1417 ± 0.5 | - | - | symmetric | 2670 ± 100 | vs | s | 35.0 | |||||
| 1416 ± 1 | - | - | undefined | 2400 ± 200 | vs | s | 95.0 | |||||
| 1415 ± 0.5 | - | - | vs | s | 225.0 |
- Label
- ν7+ν8
- Symmetry
- unknown
- Category
- combination vibration
Evaluation
- Level
- fully assigned
- Evaluation
- validated
| # | Multiplicity type | Degeneracy | Other band |
|---|---|---|---|
| 1 | unknown |
- Primary specie
- CH3CN
- Label (type)
- ν7 (bending asym. in-p (rocking)) Bond: -C ≤ H3
Vibration modes
Resonance #1
- Type
- Fermi resonance
- Band
- ν6 (1451.0 cm-1) of CH3CN
- Comments
- None
- Composition
- metastable-beta CH3CN
- Temperature
- 35.0 ± 15.0 K
Temperature
- Method #1
- spectrum measurement
- Overlap
- moderately blended
- Peak
- 1417 ± 0.5 cm-1 (peak)
- Evaluation
- validated
- Quality
- A
- Shape
- symmetric
- Evaluation
- undefined
- Method
- baseline corrected peak intensity
- Absorption coefficient
- 2670 ± 100 cm-1
- Strength
- very strong (vs)
- Evaluation
- undefined
- Quality
- B
- Method
- estimated
- Strength
- strong (s)
- Evaluation
- undefined
- Composition
- metastable-beta CH3CN
- Temperature
- 95.0 ± 20.0 K
Temperature
- Method #1
- spectrum measurement
- Overlap
- shoulder-tail
- Peak
- 1416 ± 1 cm-1 (peak)
- Evaluation
- validated
- Quality
- B
- Shape
- undefined
- Evaluation
- undefined
- Method
- baseline corrected peak intensity
- Absorption coefficient
- 2400 ± 200 cm-1
- Strength
- very strong (vs)
- Evaluation
- undefined
- Quality
- C
- Method
- estimated
- Strength
- strong (s)
- Evaluation
- undefined
- Composition
- stable-beta CH3CN
- Temperature
- 225.0 ± 20.0 K
Temperature
- Method #1
- spectrum measurement
- Overlap
- unknown
- Peak
- 1415 ± 0.5 cm-1 (peak)
- Evaluation
- validated
- Quality
- A
- Method
- extrapolated
- Strength
- very strong (vs)
- Evaluation
- undefined
- Method
- extrapolated
- Strength
- strong (s)
- Publications
-
- Dello Russo and Khanna, 1996, Icarus, 123, 366 - 395
- Ennis et al., 2017, Phys. Chem. Chem. Phys., 19, 2915 - 2925
- Pace and Noe, 1968, J. Chem. Phys., 49, 5317 - 5325
- Milligan and Jacox, 1962, J. Mol. Spectrosc., 8, 126 - 133
- Abdulgalil et al., 2013, Phil. Trans. R. Soc. A, 371, 20110586
- Hudson, 2020, Icarus, 338, 113548
- Moore et al., 2010, Astrophys. J., Suppl. Ser., 191, 96 - 112