Peña-Gallego Á - Search Results

1

Common Reactivity and Properties of Heme Peroxidases: A DFT Study of Their Origin.

Ramos DR, Furtmüller PG, Obinger C, Peña-Gallego Á, Pérez-Juste I, Santaballa JA. Ramos DR, et al. Among authors: pena gallego a. Antioxidants (Basel). 2023 Jan 28;12(2):303. doi: 10.3390/antiox12020303. Antioxidants (Basel). 2023. PMID: 36829861 Free PMC article.

2

Chiroptical Symmetry Analysis: Exciton Chirality-Based Formulae to Understand the Chiroptical Responses of C_n and D_n Symmetric Systems.

Castro-Fernández S, Peña-Gallego Á, Mosquera RA, Alonso-Gómez JL. Castro-Fernández S, et al. Molecules. 2019 Jan 1;24(1):141. doi: 10.3390/molecules24010141. Molecules. 2019. PMID: 30609677 Free PMC article.

3

ON/OFF Spiroconjugation through Peripheral Functionalization: Impact on the Reactivity and Chiroptical Properties of Spirobifluorenes.

Ozcelik A, Aranda D, Pereira-Cameselle R, Talavera M, Covelo B, Santoro F, Peña-Gallego Á, Alonso-Gómez JL. Ozcelik A, et al. Among authors: pena gallego a. Chempluschem. 2022 Jun;87(6):e202100554. doi: 10.1002/cplu.202100554. Epub 2022 Apr 12. Chempluschem. 2022. PMID: 35415974

4

A MP2 and DFT study of the aromatic character of polyphosphaphospholes. Is the pyramidality the only factor to take into consideration?

Josa D, Peña-Gallego A, Rodríguez-Otero J, Cabaleiro-Lago EM. Josa D, et al. J Mol Model. 2011 Jun;17(6):1267-72. doi: 10.1007/s00894-010-0827-0. Epub 2010 Sep 2. J Mol Model. 2011. PMID: 20811801

5

Key factors in the synthesis of polycyclic iridaaromatics via the methoxyalkenylcarbene pathway.

Talavera M , Cid-Seara KM , Peña-Gallego Á , Bolaño S . Talavera M , et al. Among authors: pena gallego a. Dalton Trans. 2021 Aug 28;50(32):11216-11220. doi: 10.1039/d1dt01361k. Epub 2021 Aug 2. Dalton Trans. 2021. PMID: 34338266

6

The role of aromaticity in the planarity of lumiflavin.

Rodríguez-Otero J, Martínez-Núñez E, Peña-Gallego A, Vázquez SA. Rodríguez-Otero J, et al. J Org Chem. 2002 Sep 6;67(18):6347-52. doi: 10.1021/jo011159c. J Org Chem. 2002. PMID: 12201752

7

A DFT study of the pericyclic/pseudopericyclic character of cycloaddition reactions of ethylene and formaldehyde to buta-1,3-dien-1-one and derivatives.

Cabaleiro-Lago EM, Rodríguez-Otero J, González-López I, Peña-Gallego A, Hermida-Ramón JM. Cabaleiro-Lago EM, et al. J Phys Chem A. 2005 Jun 30;109(25):5636-44. doi: 10.1021/jp050624x. J Phys Chem A. 2005. PMID: 16833896

8

Tracking the Transition from Pericyclic to Pseudopericyclic Reaction Mechanisms Using Multicenter Electron Delocalization Analysis: The [1,3] Sigmatropic Rearrangement.

Pérez-Barcia Á, Peña-Gallego Á, Mandado M. Pérez-Barcia Á, et al. Among authors: pena gallego a. J Phys Chem A. 2021 Sep 23;125(37):8337-8344. doi: 10.1021/acs.jpca.1c06620. Epub 2021 Sep 11. J Phys Chem A. 2021. PMID: 34510896 Free PMC article.

9

Optical and electrochemical properties of spirobifluorene iridanaphthalene complexes.

Talavera M, Pereira-Cameselle R, Peña-Gallego Á, Vázquez-Carballo I, Prieto I, Alonso-Gómez JL, Bolaño S. Talavera M, et al. Among authors: pena gallego a. Dalton Trans. 2023 Jan 3;52(2):487-493. doi: 10.1039/d2dt03465d. Dalton Trans. 2023. PMID: 36504193

10

Spirobifluorene Metallaaromatics.

Arias-Coronado VC, Pereira-Cameselle R, Ozcelik A, Talavera M, Peña-Gallego Á, Alonso-Gómez JL, Bolaño S. Arias-Coronado VC, et al. Chemistry. 2019 Oct 22;25(59):13496-13499. doi: 10.1002/chem.201903213. Epub 2019 Sep 26. Chemistry. 2019. PMID: 31430403

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