Tudóstér: Purgel Mihály publikációi

Purgel, M.: Capturing the perfluorobutane sulfonate by bambus[6], calix[6] and pillar[6] derivatives: Determination of stability constants by cellmetry method.
J. Mol. Liq. 409 1-8, 2024.

Sadatsharifi, M., Purgel, M.: Determination of dissociation constants of cephalosporin antibiotics by cellmetry method.
Struct. Chem. 35 (3), 961-966, 2024.

Purgel, M.: Determination of stability constants of Cu(II)2-bistren cascade complexes by cellmetry method.
Comput. Theor. Chem. 1238 1-5, 2024.

Łyczko, K., Wiȩckowska, A., Bajnoczi, É., Csupász, T., Purgel, M., Sigfridsson, C., Tóth, I., Persson, I.: Striking stability of a mixed-valence thallium(III)-thallium(I) complex in some solvents.
J. Mol. Liq. 385 1-9, 2023.

Purgel, M.: Rigid, strained, and fexible: a DFT study of a backbone?afected monohydride formation of salen and salan complexes.
Theor. Chem. Acc. 141 (5-6), 1-8, 2022.

Sadatsharifi, M., Purgel, M.: Radical scavenger competition of alizarin and curcumin: a mechanistic DFT study on antioxidant activity.
J. Mol. Model. 27 (6), 1-13, 2021.

Hankó, G., Márton, R., Udvardy, A., Purgel, M., Kathó, Á., Joó, F., Papp, G.: Selective reduction of alkynes to alkenes with hydrogen or formic acid catalyzed by cis,mer-[IrH2Cl(mtppms)3].
Inorg. Chim. Acta. 522 1-8, 2021.

Purgel, M., Fehér, P., Balogh, Á., Bunda, S., Joó, F.: Water-mediated formation of hydride derivates from flexible Pd-salan complexes: A DFT study.
Molecular Catalysis. 500 1-9, 2021.

Fehér, P., Joó, F., Papp, G., Purgel, M.: Hydrogenation of cinnamaldehyde by water-soluble ruthenium(II) phosphine complexes: A DFT study on the selectivity and viability of trans-dihydride pathways.
Eur. J. Inorg. Chem. 2021 (3), 236-242, 2020.

Fehér, P., Lengyel, A., Stirling, A., Purgel, M., Fábián, I.: The mechanism of monochloramine disproportionation under acidic conditions.
Dalton Trans. 48 (44), 16713-16721, 2019.

Marozsán, N., Horváth, H., Kováts, É., Udvardy, A., Erdei, A., Purgel, M., Joó, F.: Catalytic racemization of secondary alcohols with new (arene)Ru(II)-NHC and (arene)Ru(II)-NHC-tertiary phosphine complexes.
Molecular Catalysis. 445 248-256, 2018.

Fehér, P., Horváth, H., Joó, F., Purgel, M.: DFT Study on the Mechanism of Hydrogen Storage Based on the Formate-Bicarbonate Equilibrium Catalyzed by an Ir-NHC Complex: An Elusive Intramolecular C-H Activation.
Inorg. Chem. 57 (10), 5903-5914, 2018.

Nagy, L., Nagy, T., Kuki, Á., Purgel, M., Zsuga, M., Kéki, S.: Kinetics of Uncatalyzed Reactions of 2,4'- and 4,4'-Diphenylmethane-Diisocyanate with Primary and Secondary Alcohols.
Int. J. Chem. Kinet. 49 (9), 643-655, 2017.

Nagy, M., Rácz, D., Nagy, Z., Nagy, T., Fehér, P., Purgel, M., Zsuga, M., Kéki, S.: An acrylated isocyanonaphthalene based solvatochromic click reagent: Optical and biolabeling properties and quantum chemical modeling.
Dyes Pigment. 133 445-457, 2016.

Nagy, L., Nagy, T., Deák, G., Kuki, Á., Purgel, M., Narmandakh, M., Iván, B., Zsuga, M., Kéki, S.: Can Nonpolar Polyisobutylenes be Measured by Electrospray Ionization Mass Spectrometry? Anion-Attachment Proved to be an Appropriate Method.
J. Am. Soc. Mass Spectrom. 27 (3), 432-442, 2016.

Nagy, L., Kuki, Á., Deák, G., Purgel, M., Vékony, Á., Zsuga, M., Kéki, S.: Gas-Phase interaction of anions with polyisobutylenes: Collision-induced dissociation study and quantum chemical modeling.
J. Phys. Chem. B. 120 (34), 9195-9203, 2016.

Nagy, M., Rácz, D., Kovács, S., Lázár, L., Fehér, P., Purgel, M., Zsuga, M., Kéki, S.: New blue light-emitting isocyanobiphenyl based fluorophores: Their solvatochromic and biolabeling properties.
J. Photochem. Photobiol. A-Chem. 318 124-134, 2016.

Fodor, T., Bányai, I., Bényei, A., Platas-Iglesias, C., Purgel, M., Horváth, G., Zékány, L., Tircsó, G., Tóth, I.: [TlIII(dota)]-: An Extraordinarily Robust Macrocyclic Complex.
Inorg. Chem. 54 (11), 5426-5437, 2015.

Nagy, T., Kuki, Á., Antal, B., Nagy, L., Purgel, M., Sipos, A., Nagy, M., Zsuga, M., Kéki, S.: Chiral differentiation of the noscapine and hydrastine stereoisomers by electrospray ionization tandem mass spectrometry.
J. Mass Spectrom. 50 (1), 240-246, 2015.

Udvardy, A., Purgel, M., Szarvas, T., Joó, F., Kathó, Á.: Synthesis and structure of stable water-soluble phosphonium alkanoate zwitterions derived from 1,3,5-triaza-7-phosphaadamantane.
Struct. Chem. 26 (5-6), 1323-1334, 2015.

Galajda, M., Fodor, T., Purgel, M., Fábián, I.: The kinetics and mechanism of the oxidation of pyruvate ion by hypochlorous acid.
RSC Adv. 5 (14), 10512-10520, 2015.

Józsa, É., Purgel, M., Bihari, M., Fehér, P., Sustyák, G., Várnagy, B., Kiss, V., Ladó, E., Ősz, K.: Kinetic studies of hydroxyquinone formation from water soluble benzoquinones.
New J. Chem. 38 (2), 588-597, 2014.

Fehér, P., Purgel, M., Joó, F.: Performance of exchange-correlation functionals on describing ground state geometries and excitations of Alizarin Red S: Effect of complexation and degree of deprotonation.
Computational and Theoretical Chemistry. 1045 113-122, 2014.

Takács, A., Napolitano, R., Purgel, M., Bényei, A., Zékány, L., Brücher, E., Tóth, I., Baranyai, Z., Aime, S.: Solution Structures, Stabilities, Kinetics, and Dynamics of DO3A and DO3A-Sulphonamide Complexes.
Inorg. Chem. 53 (6), 2858-2872, 2014.

Nagy, M., Rácz, D., Lázár, L., Purgel, M., Ditrói, T., Zsuga, M., Kéki, S.: Solvatochromic Study of Highly Fluorescent Alkylated Isocyanonaphthalenes, Their Pi-Stacking, Hydrogen-Bonding Complexation, and Quenching with Pyridine.
ChemPhysChem. 15 (16), 3614-3625, 2014.

Voronova, K., Purgel, M., Udvardy, A., Bényei, A., Kathó, Á., Joó, F.: Hydrogenation and Redox Isomerization of Allylic Alcohols Catalyzed by a New Water-Soluble Pd-tetrahydrosalen Complex.
Organometallics. 32 (15), 4391-4401, 2013.

Papp, G., Horváth, H., Purgel, M., Baranyi, A., Laurenczy, G., Joó, F.: Fully reversible formate-bicarbonate catalytic hydrogen storage cycle.
http://www.platinum.matthey.com/media-room/events/ishc-xviii-18th-international-symposium-on-homogeneous-catalysis-toulouse-france/ 18 P114, 2012.

Purgel, M., Maliarik, M., Glaser, J., Platas-Iglesias, C., Persson, I., Tóth, I.: Binuclear Pt-Tl Bonded Complex with Square Pyramidal Coordination around Pt: A Combined Multinuclear NMR, EXAFS, UV-Vis, and DFT/TDDFT Study in Dimethylsulfoxide Solution.
Inorg. Chem. 50 (13), 6163-6173, 2011.

Purgel, M., Joó, F.: DFT Study of Sulfosalen and Hydrosulfosalen Complexes in Dehalogenation Reactions.
http://chem.emt.ro/emt_chem_program_2011eng.pdf 17 1-2, 2011.

Purgel, M., Baranyai, Z., de Blas, A., Rodríguez-Blas, T., Bányai, I., Platas-Iglesias, C., Tóth, I.: An NMR and DFT Investigation on the Conformational Properties of Lanthanide(III) 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetate Analogues Containing Methylenephosphonate Pendant Arms.
J. Biol. Inorg. Chem. 49 (9), 4370-4382, 2010.

Purgel, M., Takács, Z., Jonsson, C., Nagy, L., Andersson, I., Bányai, I., Pápai, I., Persson, P., Sjoberg, S., Tóth, I.: Glyphosate complexation to aluminium(III): an equilibrium and structural study in solution using potentiometry, multinuclear NMR, ATR-FTIR, ESI-MS and DFT calculations.
J. Inorg. Biochem. 103 1426-1438, 2009.

Jószai, R., Purgel, M., Pápai, I., Wakita, H., Tóth, I.: Multinuclear NMR and DFT studies of the structure and fluxionality for MIII-ethylenediamine-tetraacetate complexes (M(EDTA)-, M = Al, Ga and In) in solution.
J. Mol. Liq. 131-132 72-80, 2007.