| 1 |
Reinvestigation of the Deceptively Simple Reaction of Toluene with OH and the Fate of the Benzyl Radical: The "Hidden" Routes to Cresols and Benzaldehyde
Salta Z, Kosmas AM, Segovia ME, Kieninger M, Tasinato N, Barone V, Ventura ON
Journal of Physical Chemistry A, 124(28), 5917, 2020 |
| 2 |
Tropospheric degradation of propanethiol initiated by Cl radicals: Kinetics, mechanism and computational studies
Cardona AL, Blanco MB, Ventura ON, Teruel MA
Chemical Physics Letters, 723, 69, 2019 |
| 3 |
Computational Evidence Suggests That 1-Chloroethanol May Be an Intermediate in the Thermal Decomposition of 2-Chloroethanol into Acetaldehyde and HCl
Salta Z, Kosmas AM, Ventura ON, Barone V
Journal of Physical Chemistry A, 123(10), 1983, 2019 |
| 4 |
Mechanism of the Organocatalyzed Decarboxylative Knoevenagel-Doebner Reaction. A Theoretical Study
Bermudez E, Ventura ON, Mendez PS
Journal of Physical Chemistry A, 114(50), 13086, 2010 |
| 5 |
On the experimental structure of monoperoxocarbonic acid and the enthalpy of formation of carbonic acid, peroxyformic acid and monoperoxocarbonic acid in gas phase
Kieninger M, Mendez PS, Ventura ON
Chemical Physics Letters, 480(1-3), 52, 2009 |
| 6 |
A new perspective in the Lewis acid catalyzed ring opening of epoxides. Theoretical study of some complexes of methanol, acetic acid, dimethyl ether, diethyl ether, and ethylene oxide with boron trifluoride
Saenz P, Cachau RE, Seoane G, Kieninger M, Ventura ON
Journal of Physical Chemistry A, 110(41), 11734, 2006 |
| 7 |
Density functional computational thermochemistry: Accurate determination of the enthalpy of formation of perfluoropropane from DFT and ab initio calculations on isodesmic reactions
Ventura ON, Segovia M
Chemical Physics Letters, 403(4-6), 378, 2005 |
| 8 |
Molecular structure and internal rotation in 2,3,5,6-tetrafluoroanisole as studied by gas-phase electron diffraction and quantum chemical calculations
Belyakov AV, Kieninger M, Cachau RE, Ventura ON, Oberhammer H
Journal of Physical Chemistry A, 109(2), 394, 2005 |
| 9 |
CCSDT study of the fluoroperoxyl radical, FOO
Denis PA, Ventura ON
Chemical Physics Letters, 385(3-4), 292, 2004 |
| 10 |
A comparative density functional study of the torsional potential of 4-fluoro (trifluoromethoxy) benzene and related species
Kieninger M, Ventura ON, Diercksen GHF
Chemical Physics Letters, 389(4-6), 405, 2004 |
