thioformamide
- Formula: CH3NS
- Molecular weight: 61.106
- IUPAC Standard InChIKey: CYEBJEDOHLIWNP-UHFFFAOYSA-N
- CAS Registry Number: 115-08-2
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Methanethioamide
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Gas phase ion energetics data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.69 | PE | Mines and Thompson, 1975 | |
8.70 | PE | Kimura, Katsumata, et al., 1981 | Vertical value |
8.70 | PE | Henriksen, Isaksson, et al., 1981 | Vertical value |
References
Go To: Top, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Mines and Thompson, 1975
Mines, G.W.; Thompson, H.W.,
The photoelectron spectra of amides, thioamides, ureas and thioureas,
Spectrochim. Acta, 1975, 31, 137. [all data]
Kimura, Katsumata, et al., 1981
Kimura, K.; Katsumata, S.; Achiba, Y.; Yamazaki, T.; Iwata, S.,
Ionization energies, Ab initio assignments, and valence electronic structure for 200 molecules
in Handbook of HeI Photoelectron Spectra of Fundamental Organic Compounds, Japan Scientific Soc. Press, Tokyo, 1981. [all data]
Henriksen, Isaksson, et al., 1981
Henriksen, L.; Isaksson, R.; Liljefors, T.; Sandstrom, J.,
Ultraviolet absorption and photoelectron spectra of some cyclic and open-chain mono- and dithiooxamides,
Acta Chem. Scand., Ser. B, 1981, 35, 489. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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