2(1H)-Pyridinone

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Phase change 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: William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Δsub86.6 ± 1.3kJ/molCSuradi, El Saiad, et al., 1982See also Pedley, Naylor, et al., 1986.

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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

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Individual Reactions

2(1H)-Pyridinone = pyridin-2-ol

By formula: C5H5NO = C5H5NO

Quantity Value Units Method Reference Comment
Δr0.88kJ/molEqkCook, Katritzky, et al., 1976liquid phase; solvent: benzene
Δr-4.6kJ/molEqkCook, Katritzky, et al., 1976liquid phase; solvent: Cyclohexane

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 evaluated as indicated in comments:
L - Sharon G. Lias

Data compiled as indicated in comments:
LL - Sharon G. Lias and Joel F. Liebman
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Quantity Value Units Method Reference Comment
IE (evaluated)8.448 ± 0.001eVN/AN/AL

Ionization energy determinations

IE (eV) Method Reference Comment
8.4479 ± 0.0006TEOzeki, Cockett, et al., 1995LL
9.0 ± 0.1EIStefanovic and Grutzmacher, 1974LLK
8.62 ± 0.03PECook, El-Abbady, et al., 1977Vertical value; LLK

References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Suradi, El Saiad, et al., 1982
Suradi, S.; El Saiad, N.; Pilcher, G.; Skinner, H.A., Enthalpies of combustion of the three hydroxy-pyridines and the four hydroxy-2-methylpyridines, J. Chem. Thermodyn., 1982, 14, 45-50. [all data]

Pedley, Naylor, et al., 1986
Pedley, J.B.; Naylor, R.D.; Kirby, S.P., Thermochemical Data of Organic Compounds, 1986, https://doi.org/10.1007/978-94-009-4099-4 . [all data]

Cook, Katritzky, et al., 1976
Cook, M.J.; Katritzky, A.R.; Hepler, L.G.; Matsui, T., Heats of solution and tautomeric equilibrium constants. The 2-pyridone: 2-hydroxypyridine equilibrium in non-aqueous media, Tetrahedron Lett., 1976, 2685-2688. [all data]

Ozeki, Cockett, et al., 1995
Ozeki, H.; Cockett, M.C.R.; Okuyama, K.; Takahashi, M.; Kumura, K., Structural isomers and tautomerism of 2-hydroxypyridine in the cation ground state studied by zero kinetic energy (ZEKE) photoelectron spectroscopy, J. Phys. Chem., 1995, 99, 8608. [all data]

Stefanovic and Grutzmacher, 1974
Stefanovic, D.; Grutzmacher, H.F., The ionisation potential of some substituted pyridines, Org. Mass Spectrom., 1974, 9, 1052. [all data]

Cook, El-Abbady, et al., 1977
Cook, M.J.; El-Abbady, S.; Katritzky, A.R.; Guimon, C.; Pfister-Guillouzo, G., Photoelectron spectra of hydroxy- and mercapto-pyridines and models of fixed structure, J. Chem. Soc. Perkin Trans. 2, 1977, 1652. [all data]


Notes

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