2-Propenoic acid, 2-(acetylamino)-
- Formula: C5H7NO3
- Molecular weight: 129.1140
- IUPAC Standard InChIKey: UFDFFEMHDKXMBG-UHFFFAOYSA-N
- CAS Registry Number: 5429-56-1
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Acrylic acid, 2-acetamido-; α-Acetamidoacrylic acid; N-Acetyldehydroalanine; 2-Acetamidoacrylic acid; Acetyldehydroalanine; 2-Acetamidocrylic acid
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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 as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.4 | PE | Ajo, Casarin, et al., 1984 | LBLHLM |
8.88 | PE | Ajo, Casarin, et al., 1984 | Vertical value; LBLHLM |
9.24 | PE | Ajo, Granozzi, et al., 1980 | Vertical value; LLK |
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.
Ajo, Casarin, et al., 1984
Ajo, D.; Casarin, M.; Granozzi, G.; Ottenheijm, H.C.J.; Plate, R.,
An investigation of the electronic structure of α,β-unsaturated acetylamino acid ethyl esters using He(I) and He(II) photoelectron spectroscopy,
Recl. Trav. Chim. Pays-Bas, 1984, 103, 365. [all data]
Ajo, Granozzi, et al., 1980
Ajo, D.; Granozzi, G.; Ciliberto, E.; Fragala, I.,
Investigation of the electronic structure of 2-(acetylamino)prop-2-enoic acid (N-acetyldehydroalanine) by HeI and HeII photoelectron spectroscopy,
J. Chem. Soc. Perkin Trans. 2, 1980, 483. [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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