Al-Msiedeen, Ashraf M. and Al-Mazaideh, Ghassab M. and Khalil, Salim M. (2016) A Theoretical Study of the Enol Contents of Cyclohexanone, Cyclopentanone and Acetone. American Chemical Science Journal, 13 (4). pp. 1-8. ISSN 22490205
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Official URL: https://doi.org/10.9734/ACSJ/2016/25048
Abstract
PM3 and DFT calculations have been performed with complete optimization of geometries on cyclohexanone, cyclopentanone, and acetone. The enol content trend determined in this work was cyclohexanone > cyclopentanone > acetone, which was found to agree with published experimental and theoretical works. Equilibrium constants, strain energies of enols, and electron distributions are reported.
| Item Type: | Article |
|---|---|
| Subjects: | Eprints AP open Archive > Chemical Science |
| Depositing User: | Unnamed user with email admin@eprints.apopenarchive.com |
| Date Deposited: | 11 Jul 2023 05:24 |
| Last Modified: | 29 Jan 2024 06:20 |
| URI: | http://asian.go4sending.com/id/eprint/495 |
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