prikaz prve stranice dokumenta Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study
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Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study
Croatica Chemica Acta, 90 (2017), 4; 589-594. https://doi.org/10.5562/cca3229
Havaić, Valentina; Djaković, Senka; Lapić, Jasmina; Weitner, Tin; Šakić, Davor; Vrček, Valerije

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Havaić, V., Djaković, S., Lapić, J., Weitner, T., Šakić, D. i Vrček, V. (2017). Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study. Croatica Chemica Acta, 90. (4), 589-594. doi: 10.5562/cca3229

Havaić, Valentina, et al. "Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study." Croatica Chemica Acta, vol. 90, br. 4, 2017, str. 589-594. https://doi.org/10.5562/cca3229

Havaić, Valentina, Senka Djaković, Jasmina Lapić, Tin Weitner, Davor Šakić i Valerije Vrček. "Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study." Croatica Chemica Acta 90, br. 4 (2017): 589-594. https://doi.org/10.5562/cca3229

Havaić, V., et al. (2017) 'Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study', Croatica Chemica Acta, 90(4), str. 589-594. doi: 10.5562/cca3229

Havaić V, Djaković S, Lapić J, Weitner T, Šakić D, Vrček V. Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study. Croatica Chemica Acta [Internet]. 2017. [pristupljeno 18.04.2024.];90(4):589-594. doi: 10.5562/cca3229

V. Havaić, S. Djaković, J. Lapić, T. Weitner, D. Šakić i V. Vrček, "Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study", Croatica Chemica Acta, vol. 90, br. 4, str. 589-594, 2017. [Online]. Dostupno na: https://urn.nsk.hr/urn:nbn:hr:163:179779. [Citirano: 18.04.2024.]

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Naslov (engleski)Reduction potential of ferrocenoyl-substituted nucleobases. Experimental and computational study
AutorValentina Havaić
AutorSenka Djaković https://orcid.org/0000-0002-6322-1770
AutorJasmina Lapić https://orcid.org/0000-0003-3177-7536
AutorTin Weitner
AutorDavor Šakić
AutorValerije Vrček
Autorova ustanovaSveučilište u Zagrebu
Farmaceutsko-biokemijski fakultet
(Zavod za opću i anorgansku kemiju)
Znanstveno / umjetničko
područje, polje i grana		PRIRODNE ZNANOSTI
Kemija
Anorganska kemija
Sažetak (engleski)
Organometallic derivatives of nucleobases are characterized by distinctive biological and electrochemical properties. In this work, reduction potentials of ferrocenoyl-substituted nucleobases (uracil, 5-fluorouracil, and thymine) were measured by cyclic voltammetry and calculated by using density functional methods. Both experimental (281– 296 mV) and calculated (271–293 mV) values for reduction potential E°’ show that these conjugates are much better oxidants than the parent ferrocene system. In search for the computational model, which can successfully reproduce experimental results, the M06-2X functional appeared as the optimal method in terms of efficiency and accuracy. <br><a rel="license" href="http://creativecommons.org/licenses/by/4.0/"><img alt="Creative Commons License" style="border-width:0" src="https://i.creativecommons.org/l/by/4.0/80x15.png" /></a> This work is licensed under a <a rel="license" href="http://creativecommons.org/licenses/by/4.0/">Creative Commons Attribution 4.0 International License</a>.
Ključne riječi (engleski)
Jezikengleski
Vrsta publikacijeZnanstveni rad - Izvorni znanstveni rad
Status objaveObjavljen
Vrsta recenzijeRecenziran - međunarodna recenzija
Verzija publikacijeObjavljena verzija rada (izdavačev PDF)
Naslov časopisaCroatica Chemica Acta
Brojčani podacivol. 90, br. 4, str. 589-594
p-ISSN0011-1643
e-ISSN1334-417X
DOIhttps://doi.org/10.5562/cca3229
URN:NBNurn:nbn:hr:163:179779
Datum objave publikacije2017
URL dokumentahttps://hrcak.srce.hr/198183
Vrsta resursaTekst
Prava pristupaOtvoreni pristup
Uvjeti korištenjaIkona licence Zaštićeno autorskim pravom.
Datum i vrijeme pohrane2020-04-14 16:56:48