1-CHO-cyclopropanide anion
- Formula: C4H5O-
- Molecular weight: 69.0824
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Reaction thermochemistry 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: John E. Bartmess
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Individual Reactions
C4H5O- + =
By formula: C4H5O- + H+ = C4H6O
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 375.8 ± 2.1 | kcal/mol | G+TS | Chou, Dahlke, et al., 1993 | gas phase; barrier for opening to CH2=C(CHO)CH2-: 29 kcal/mol. |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔrG° | 368.7 ± 2.0 | kcal/mol | IMRE | Chou, Dahlke, et al., 1993 | gas phase; barrier for opening to CH2=C(CHO)CH2-: 29 kcal/mol. |
Gas phase ion energetics data
Go To: Top, Reaction thermochemistry data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: John E. Bartmess
Protonation reactions
C4H5O- + =
By formula: C4H5O- + H+ = C4H6O
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 375.8 ± 2.1 | kcal/mol | G+TS | Chou, Dahlke, et al., 1993 | gas phase; barrier for opening to CH2=C(CHO)CH2-: 29 kcal/mol. |
| Quantity | Value | Units | Method | Reference | Comment |
| ΔrG° | 368.7 ± 2.0 | kcal/mol | IMRE | Chou, Dahlke, et al., 1993 | gas phase; barrier for opening to CH2=C(CHO)CH2-: 29 kcal/mol. |
References
Go To: Top, Reaction thermochemistry data, 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.
Chou, Dahlke, et al., 1993
Chou, P.K.; Dahlke, G.D.; Kass, S.R.,
Unimolecular Rearrangements of Carbanions in the Gas Phase .2. Cyclopropyl Anions,
J. Chem. Soc. Chem. Comm., 1993, 115, 1, 315, https://doi.org/10.1021/ja00054a045
. [all data]
Notes
Go To: Top, Reaction thermochemistry data, Gas phase ion energetics data, References
- Symbols used in this document:
ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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