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M. A. Ortuño · SciRah

Researcher profile · Semantic Scholar

M. A. Ortuño

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M. A. Ortuño — researcher profile on SciRah

h-index: 29
Works: 74
Citations: 3,308

Most-cited papers

A heterogeneous single-atom palladium catalyst surpassing homogeneous systems for Suzuki coupling
Zu-Peng Chen, E. Vorobyeva, S. Mitchell, Edvin Fako +7 more
2018Nature Nanotechnology535 citations Open access
Semantic Scholar
Methane Oxidation to Methanol Catalyzed by Cu-Oxo Clusters Stabilized in NU-1000 Metal-Organic Framework.
Takaaki Ikuno, Jian Zheng, Aleksei Vjunov, M. Sanchez-Sanchez +13 more
2017Journal of the American Chemical Society303 citations
Semantic Scholar
Metal–Organic Framework Supported Cobalt Catalysts for the Oxidative Dehydrogenation of Propane at Low Temperature
Zhanyong Li, A. W. Peters, Varinia Bernales, M. A. Ortuño +9 more
2016ACS Central Science217 citations Open access
Semantic Scholar
An Exceptionally Stable Metal-Organic Framework Supported Molybdenum(VI) Oxide Catalyst for Cyclohexene Epoxidation.
Hyunho Noh, Yuexing Cui, A. W. Peters, Dale R. Pahls +6 more
2016Journal of the American Chemical Society217 citations
Semantic Scholar
Computational Design of Functionalized Metal–Organic Framework Nodes for Catalysis
Varinia Bernales, M. A. Ortuño, D. Truhlar, C. J. Cramer +1 more
2017ACS Central Science165 citations Open access
Semantic Scholar
Structure and Dynamics of Zr6O8 Metal-Organic Framework Node Surfaces Probed with Ethanol Dehydration as a Catalytic Test Reaction.
Dong Yang, M. A. Ortuño, Varinia Bernales, C. J. Cramer +2 more
2018Journal of the American Chemical Society163 citations
Semantic Scholar
Presence versus Proximity: The Role of Pendant Amines in the Catalytic Hydrolysis of a Nerve Agent Simulant.
Timur Islamoglu, M. A. Ortuño, Emmanuel Proussaloglou, Ashlee J. Howarth +5 more
2018Angewandte Chemie153 citations
Semantic Scholar
Selective Methane Oxidation to Methanol on Cu-Oxo Dimers Stabilized by Zirconia Nodes of an NU-1000 Metal-Organic Framework.
Jian Zheng, Jingyun Ye, M. A. Ortuño, J. Fulton +13 more
2019Journal of the American Chemical Society150 citations
Semantic Scholar
Accessing Frustrated Lewis Pair Chemistry through Robust Gold@N-Doped Carbon for Selective Hydrogenation of Alkynes
J. Fiorio, R. V. Goncalves, É. Teixeira-Neto, M. A. Ortuño +2 more
201889 citations Open access
Semantic Scholar
The Transmetalation Process in Suzuki–Miyaura Reactions: Calculations Indicate Lower Barrier via Boronate Intermediate
M. A. Ortuño, A. Lledós, F. Maseras, Gregori Ujaque
201469 citations
Semantic Scholar
Gas reactions under intrapore condensation regime within tailored metal–organic framework catalysts
I. Agirrezabal-Telleria, I. Luz, M. A. Ortuño, Mikel Oregui-Bengoechea +4 more
2019Nature Communications57 citations Open access
Semantic Scholar
Unit root and stationarity tests’ wedding
Josep Lluís Carrion-i-Silvestre, Andreu Sansó-i-Rosselló, M. A. Ortuño
200157 citations
Semantic Scholar
True and masked three-coordinate T-shaped platinum(II) intermediates
M. A. Ortuño, Salvador Conejero, A. Lledós
2013Beilstein Journal of Organic Chemistry55 citations Open access
Semantic Scholar
Nickel Catalysts for the Dehydrative Decarbonylation of Carboxylic Acids to Alkenes
A. John, M. Miranda, Keying Ding, B. Dereli +5 more
201652 citations
Semantic Scholar
Computational Screening of Bimetal-Functionalized Zr6O8 MOF Nodes for Methane C-H Bond Activation.
Dale R. Pahls, M. A. Ortuño, P. H. Winegar, C. J. Cramer +1 more
2017Inorganic Chemistry50 citations
Semantic Scholar
C–H Bond Activation on Bimetallic Two-Atom Co-M Oxide Clusters Deposited on Zr-Based MOF Nodes: Effects of Doping at the Molecular Level
Matthew C Simons, M. A. Ortuño, Varinia Bernales, C. Gaggioli +3 more
201846 citations
Semantic Scholar
Mechanically Constrained Catalytic Mn(CO)3Br Single Sites in a Two-Dimensional Covalent Organic Framework for CO2 Electroreduction in H2O
G. Dubed-Bandomo, Suvendu Mondal, Federico Franco, Alberto Bucci +6 more
202145 citations Open access
Semantic Scholar
Mechanistic studies on the Pd-catalyzed vinylation of aryl halides with vinylalkoxysilanes in water: the effect of the solvent and NaOH promoter.
Á. Gordillo, M. A. Ortuño, C. López-Mardomingo, A. Lledós +2 more
2013Journal of the American Chemical Society45 citations
Semantic Scholar
Computational Study of First-Row Transition Metals Supported on MOF NU-1000 for Catalytic Acceptorless Alcohol Dehydrogenation
M. A. Ortuño, Varinia Bernales, L. Gagliardi, C. J. Cramer
201643 citations Open access
Semantic Scholar
Tuning N-heterocyclic carbenes in T-shaped Pt(II) complexes for intermolecular C-H bond activation of arenes.
Orestes Rivada‐Wheelaghan, M. A. Ortuño, J. Díez, A. Lledós +1 more
2012Angewandte Chemie40 citations Open access
Semantic Scholar
Ruthenium-Catalyzed Oxidative Coupling of Primary Amines with Internal Alkynes through C-H Bond Activation: Scope and Mechanistic Studies.
S. Ruiz, P. Villuendas, M. A. Ortuño, A. Lledós +1 more
2015Chemistry37 citations
Semantic Scholar
Internal Alkyne Isomerization to Vinylidene versus Stable π-Alkyne: Theoretical and Experimental Study on the Divergence of Analogous Cp*Ru and TpRu Systems
V. K. Singh, E. Bustelo, I. de los Ríos, Ignacio Macías‐Arce +5 more
201137 citations
Semantic Scholar
Selective Electrochemical Nitrogen Reduction Driven by Hydrogen Bond Interactions at Metal-Ionic Liquid Interfaces.
M. A. Ortuño, Oldamur Hollóczki, B. Kirchner, N. López
2019Journal of Physical Chemistry Letters35 citations Open access
Semantic Scholar
Counteranion and solvent assistance in ruthenium-mediated alkyne to vinylidene isomerizations.
M. Jiménez-Tenorio, M. Puerta, P. Valerga, M. A. Ortuño +2 more
2013Inorganic Chemistry35 citations Open access
Semantic Scholar
Chirality Transfer in Gold Nanoparticles by l-Cysteine Amino Acid: A First-Principles Study
Jordi Morales-Vidal, N. López, M. A. Ortuño
2019Journal of Physical Chemistry C32 citations Open access
Semantic Scholar
Activation of Copper Species on Carbon Nitride for Enhanced Activity in the Arylation of Amines
E. Vorobyeva, Viktoria C. Gerken, S. Mitchell, Albert Sabadell‐Rendón +14 more
2020ACS Catalysis30 citations Open access
Semantic Scholar
The role of ligand redox non-innocence in ring-opening polymerization reactions catalysed by bis(imino)pyridine iron alkoxide complexes.
K. R. Delle Chiaie, A. B. Biernesser, M. A. Ortuño, B. Dereli +5 more
2017Dalton Transactions30 citations
Semantic Scholar
Selective Decarbonylation of Fatty Acid Esters to Linear α-Olefins
A. John, B. Dereli, M. A. Ortuño, H. E. Johnson +3 more
201729 citations
Semantic Scholar
Characterization of a paramagnetic, mononuclear Pt(III)-alkyl complex intermediate in carbon-halogen bond coupling reactions.
Orestes Rivada‐Wheelaghan, M. A. Ortuño, J. Díez, Sergio E. García-Garrido +3 more
2012Journal of the American Chemical Society29 citations Open access
Semantic Scholar
The Role of Alkoxide Initiator, Spin State, and Oxidation State in Ring-Opening Polymerization of ε-Caprolactone Catalyzed by Iron Bis(imino)pyridine Complexes.
M. A. Ortuño, B. Dereli, Kayla R. Delle Chiaie, A. B. Biernesser +3 more
2018Inorganic Chemistry28 citations
Semantic Scholar
Mechanism of Pd-Catalyzed Decarbonylation of Biomass-Derived Hydrocinnamic Acid to Styrene following Activation as an Anhydride.
M. A. Ortuño, B. Dereli, C. J. Cramer
2016Inorganic Chemistry28 citations
Semantic Scholar
Reaction mechanisms at the homogeneous–heterogeneous frontier: insights from first-principles studies on ligand-decorated metal nanoparticles
M. A. Ortuño, N. López
2019Catalysis science & technology26 citations Open access
Semantic Scholar
Evidence for a Sigmatropic and an Ionic Pathway in the Winstein Rearrangement
Amy A Ott, Mary H. Packard, M. A. Ortuño, Alayna M. Johnson +3 more
2018Journal of Organic Chemistry23 citations Open access
Semantic Scholar
Atomic layer deposition of Cu(i) oxide films using Cu(ii) bis(dimethylamino-2-propoxide) and water.
J. Avila, A. W. Peters, Zhan-Yong Li, M. A. Ortuño +4 more
2017Dalton Transactions23 citations
Semantic Scholar
Reactivity of coordinatively unsaturated bis(N-heterocyclic carbene) Pt(II) complexes toward H(2). Crystal structure of a 14-electron Pt(II) hydride complex.
Orestes Rivada‐Wheelaghan, Marta Roselló-Merino, M. A. Ortuño, Pietro Vidossich +3 more
2014Inorganic Chemistry23 citations
Semantic Scholar
Efficient Hydrosilylation of Acetophenone with a New Anthraquinonic Amide-Based Iron Precatalyst
Álvaro Raya‐Barón, M. A. Ortuño, P. Oña-Burgos, A. Rodríguez-Diéguez +4 more
201622 citations
Semantic Scholar
Do metal⋅⋅⋅water hydrogen bonds hold in solution? Insight from ab initio molecular dynamics simulations.
Pietro Vidossich, M. A. Ortuño, Gregori Ujaque, A. Lledós
2011ChemPhysChem22 citations
Semantic Scholar
Mechanistic Insight into the Facilitation of β-Lactam Fragmentation through Metal Assistance.
Luis Casarrubios, Miguel A. Esteruelas, Carmen Larramona, A. Lledós +4 more
2015Chemistry21 citations Open access
Semantic Scholar
Solution dynamics of agostic interactions in T-shaped Pt(II) complexes from ab initio molecular dynamics simulations.
M. A. Ortuño, Pietro Vidossich, Gregori Ujaque, Salvador Conejero +1 more
2013Dalton Transactions21 citations
Semantic Scholar
Multireference Electronic Structures of Fe-Pyridine(diimine) Complexes over Multiple Oxidation States.
M. A. Ortuño, C. J. Cramer
2017Journal of Physical Chemistry A20 citations
Semantic Scholar
Coordinatively Unsaturated T-Shaped Platinum(II) Complexes Stabilized by Small N-Heterocyclic Carbene Ligands. Synthesis and Cyclometalation
Marta Roselló-Merino, Orestes Rivada‐Wheelaghan, M. A. Ortuño, Pietro Vidossich +3 more
201420 citations Open access
Semantic Scholar
Computational Mechanism of Methyl Levulinate Conversion to γ-Valerolactone on UiO-66 Metal Organic Frameworks
M. A. Ortuño, Marcos Rellán‐Piñeiro, R. Luque
2022ACS Sustainable Chemistry and Engineering17 citations Open access
Semantic Scholar
Accurate Ionization Energies for Mononuclear Copper Complexes Remain a Challenge for Density Functional Theory.
B. Dereli, M. A. Ortuño, C. J. Cramer
2018ChemPhysChem17 citations
Semantic Scholar
Creating Cavities at Palladium–Phosphine Interfaces for Enhanced Selectivity in Heterogeneous Biomass Conversion
M. A. Ortuño, N. López
201817 citations Open access
Semantic Scholar
A stable, mononuclear, cationic Pt(III) complex stabilised by bulky N-heterocyclic carbenes.
Orestes Rivada‐Wheelaghan, M. A. Ortuño, Sergio E. García-Garrido, J. Díez +3 more
2014Chemical Communications15 citations Open access
Semantic Scholar
Orbital-like motion of hydride ligands around low-coordinate metal centers.
M. A. Ortuño, Pietro Vidossich, Salvador Conejero, A. Lledós
2014Angewandte Chemie15 citations Open access
Semantic Scholar
Unprecedented Spectroscopic and Computational Evidence for Allenyl and Propargyl Titanocene(IV) Complexes: Electrophilic Quenching of Their Metallotropic Equilibrium.
Ana Belén Ruiz-Muelle, P. Oña-Burgos, M. A. Ortuño, J. Oltra +2 more
2016Chemistry14 citations
Semantic Scholar
Response surfaces estimates for the Dickey-Fuller unit root test with structural breaks
J. Silvestre, Andreu Sansó Rosselló, M. A. Ortuño
199914 citations
Semantic Scholar
Desulfinylation of Ag(I) Sulfinyl Mesoionic Carbenes: Preparation of C-Unsubstituted Au(I)-1,2,3-Triazole Carbene Complexes.
M. Frutos, M. A. Ortuño, A. Lledós, A. Viso +5 more
2017Organic Letters13 citations
Semantic Scholar
Spectroscopic Evidence of Hyponitrite Radical Intermediate in NO Disproportionation at a MOF-Supported Mononuclear Copper Site.
Chenyue Sun, Luming Yang, M. A. Ortuño, Ashley M. Wright +4 more
2021Angewandte Chemie12 citations
Semantic Scholar

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