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- On the energetics of radical adduct formation of OH center dot with phenol analogs and aniline / aut. Dagmar Štellerová, Vladimír Lukeš
Štellerová Dagmar ; 045280 Lukeš Vladimír ; 045280
Acta Chimica Slovaca . Vol. 15, iss. 1 (2022), s. 12-17
Bond dissociation enthalpy DFT hydroxyl radical thermodynamics
https://sciendo.com/article/10.2478/acs-2022-0002
článok z periodika
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V3 - Vedecký výstup publikačnej činnosti z časopisu
article
- Thermochemistry of antioxidant action of isoflavones and their deprotonated forms in aqueous solution: hydrogen or electron transfer? / aut. Monika Biela, Andrea Kleinová, Erik Klein
Biela Monika ; 045210 Kleinová Andrea ; 045210 Klein Erik ; 045210
Acta Chimica Slovaca . Vol. 15, iss. 1 (2022), s. 29-35
Bond dissociation enthalpy Consecutive deprotonations Electron transfer Phenoxide anion
https://sciendo.com/it/article/10.2478/acs-2022-0004
článok z periodika
ADN - 13/NOVÉ Vedecké práce v domácich časopisoch registrovaných v databázach Web of Science alebo SCOPUS
V3 - Vedecký výstup publikačnej činnosti z časopisuarticle
- Phenolic acids and their carboxylate anions: Thermodynamics of primary antioxidant action / aut. Monika Biela, Andrea Kleinová, Erik Klein
Biela Monika ; 045210 Kleinová Andrea ; 045210 Klein Erik ; 045210
Phytochemistry : . Vol. 200, (2022), s. [1-8], art. no. 113254
Chain-breaking antioxidant Bond dissociation enthalpy Ionization potential Proton affinity Demethylation
https://www.sciencedirect.com/science/article/pii/S0031942222001704
článok z periodika
ADC - Scientific titles in foreign carented magazines and noticed year-books
V3 - Vedecký výstup publikačnej činnosti z časopisuarticle
- Guaiacol oxidation: theoretical insight into thermochemistry of radical processes involving methoxy group demethylation / aut. Monika Biela, Andrea Kleinová, Erik Klein
Biela Monika ; 045210 Kleinová Andrea ; 045210 Klein Erik ; 045210
Free Radical Research . Vol. 56, iss. 11-12 (2022), s. 730-739
Ortho-methoxyphenol oxidation Demethylation Bond dissociation enthalpy
https://www.tandfonline.com/doi/full/10.1080/10715762.2023.2170880
článok z periodika
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V3 - Vedecký výstup publikačnej činnosti z časopisuarticle
- Effects of Substitution and Torsional Deformation on the Energetics of Homolytic N-H Bond Cleavage in Diphenylamine Derivatives
Poliak Peter ; C5210 Vagánek Adam ; C5210 Lukeš Vladimír ; C5280 Klein Erik ; C5210
Scientific Meeting of Institute of Physical Chemistry and Chemical Physics, Kočovce 28.-30.5.2014 : . e-book, s. 29-30
diphenylamine Bond dissociation enthalpy antioxidant Hammett constant dihedral angle
článok zo zborníka
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V2 - Vedecký výstup publikačnej činnosti ako časť editovanej knihy alebo zborníkaarticle
- Oxidation of sterols: Energetics of C-H and O-H bond cleavage
Lengyel Jozef Rimarčík Ján ; C5280 Vagánek Adam ; C5210 Fedor Juraj Lukeš Vladimír ; C5280 Klein Erik ; C5210
Food Chemistry . Vol. 133, Iss. 4 (2012), s.1435-1440
antioxidant Bond dissociation enthalpy Density Functional Theory oxidation Phytosterol
článok z periodika
ADC - Scientific titles in foreign carented magazines and noticed year-books
V3 - Vedecký výstup publikačnej činnosti z časopisuarticle