CH2CHO
- Formula: C2H3O
- Molecular weight: 43.0446
- IUPAC Standard InChIKey: FATAVLOOLIRUNA-UHFFFAOYSA-N
- CAS Registry Number: 4400-01-5
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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Gas phase ion energetics data
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data evaluated as indicated in comments:
HL - Edward P. Hunter and Sharon G. Lias
Data compiled as indicated in comments:
B - John E. Bartmess
View reactions leading to C2H3O+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Proton affinity (review) | 185. | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 177.2 | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
1.820 ± 0.010 | LPES | Goebbert, Khuseynov, et al., 2011 | B |
1.82481 | LPES | Mead, Lykke, et al., 1984 | Uncertainty: 6 millical/mol (0.26 micro-eV).Dipolebound state at ca. 14.3 cal/mol (5 cm-1); B |
1.817 ± 0.023 | LPES | Ellison, Engleking, et al., 1982 | B |
1.795 ± 0.015 | LPES | Alconcel, Deyerl, et al., 1999 | B |
1.8240 ± 0.0050 | LPD | Jackson, Hiberty, et al., 1981 | Bands due to dipole-supported state observed.; B |
1.808 ± 0.061 | PD | Zimmerman, Reed, et al., 1977 | B |
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.
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Goebbert, Khuseynov, et al., 2011
Goebbert, D.J.; Khuseynov, D.; Sanov, A.,
O- + Acetaldehyde Reaction Products: Search for Singlet Formylmethylene, a Wolff Rearrangement intermediate,
J. Phys. Chem. A, 2011, 115, 15, 3208-3217, https://doi.org/10.1021/jp112331y
. [all data]
Mead, Lykke, et al., 1984
Mead, R.D.; Lykke, K.R.; Lineberger, W.C.; Marks, J.; Brauman, J.I.,
Spectroscopy and Dynamics of the Dipole-Bound State of Acetaldehyde Enolate.,
J. Chem. Phys., 1984, 81, 11, 4883., https://doi.org/10.1063/1.447515
. [all data]
Ellison, Engleking, et al., 1982
Ellison, G.B.; Engleking, P.C.; Lineberger, W.C.,
Photoelectron spectroscopy of alkoxide and enolate negative ions,
J. Phys. Chem., 1982, 86, 4873. [all data]
Alconcel, Deyerl, et al., 1999
Alconcel, L.S.; Deyerl, H.J.; Zengin, V.; Continetti, R.E.,
Structure and energetics of vinoxide and the X((2)A) and A((2)A') vinoxy radicals,
J. Phys. Chem. A, 1999, 103, 46, 9190-9194, https://doi.org/10.1021/jp992126s
. [all data]
Jackson, Hiberty, et al., 1981
Jackson, R.L.; Hiberty, P.C.; Brauman, J.I.,
Threshold Resonances in the Electron Photodetachment spectrum of Acetaldehyde Anion. Evidence for a low-lying Dipole Supported State.,
J. Chem. Phys., 1981, 74, 7, 3705, https://doi.org/10.1063/1.441598
. [all data]
Zimmerman, Reed, et al., 1977
Zimmerman, A.H.; Reed, K.J.; Brauman, J.I.,
Photodetachment of electrons from enolate anions. Gas phase electron affinities of enolate radicals,
J. Am. Chem. Soc., 1977, 99, 7203. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Symbols used in this document:
EA Electron affinity - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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