Works by Faza, Olalla

Results: 25

Pseudorotation of Natural and Chemically Modified Biological Phosphoranes: Implications for RNA Catalysis.

Published in:

ChemPhysChem, 2004, v. 5, n. 9, p. 1266, doi. 10.1002/cphc.200490049

By:

Carlos Silva López;
Olalla Nieto Faza;
Brent A. Gregersen;
Xabier Lopez;
Angel R. de Lera;
Darrin M. York

Publication type:

Article

Pseudorotation of Natural and Chemically Modified Biological Phosphoranes: Implications for RNA Catalysis.

Published in:

ChemPhysChem, 2004, v. 5, n. 7, p. 1045, doi. 10.1002/cphc.200400091

By:

Carlos Silva López;
Olalla Nieto Faza;
Brent A. Gregersen;
Xabier Lopez;
Angel R. de Lera;
Darrin M. York

Publication type:

Article

On the Use of Popular Basis Sets: Impact of the Intramolecular Basis Set Superposition Error.

Published in:

Molecules, 2019, v. 24, n. 20, p. 3810, doi. 10.3390/molecules24203810

By:

Vidal Vidal, Ángel;
de Vicente Poutás, Luis Carlos;
Nieto Faza, Olalla;
Silva López, Carlos;
Andrada, Diego

Publication type:

Article

Copper-Catalyzed Skeletal Rearrangement of O-Propargyl Oximes: A Mechanistic Manifold.

Published in:

ChemCatChem, 2016, v. 8, n. 16, p. 2696, doi. 10.1002/cctc.201600473

By:

González Comesaña, Marta;
Nieto Faza, Olalla;
Cid, María MagdalENa;
Silva López, Carlos

Publication type:

Article

The Outer-Sphere Mechanism of Nitrene Transfer onto Gold(I) Alkyne Complexes.

Published in:

ChemCatChem, 2016, v. 8, n. 14, p. 2387, doi. 10.1002/cctc.201600354

By:

Costa, Ismael;
Marín‐Luna, Marta;
Comesaña, Marta González;
Faza, Olalla Nieto;
Silva López, Carlos

Publication type:

Article

Pseudorotation Barriers of Biological Oxyphosphoranes: A Challenge for Simulations of Ribozyme Catalysis.

Published in:

Chemistry - A European Journal, 2005, v. 11, n. 7, p. 2081, doi. 10.1002/chem.200400790

By:

Carlos Silva López;
Olalla Nieto Faza;
Angel R. de Lera;
Darrin M. York

Publication type:

Article

Ellipticity: A Convenient Tool To Characterize Electrocyclic Reactions.

Published in:

Chemistry - A European Journal, 2005, v. 11, n. 6, p. 1734, doi. 10.1002/chem.200401026

By:

Carlos Silva López;
Olalla Nieto Faza;
Fernando P. Cossío;
Darrin M. York;
Angel R. de Lera

Publication type:

Article

Theoretical Study of the Electrocyclic Ring Closure of Hydroxypentadienyl Cations.

Published in:

Chemistry - A European Journal, 2004, v. 10, n. 17, p. 4324, doi. 10.1002/chem.200400037

By:

Olalla Nieto Faza;
Carlos Silva López;
Rosana Álvarez;
Ángel R. de Lera

Publication type:

Article

Performance of density functional theory on homogeneous gold catalysis.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2011, v. 128, n. 4-6, p. 647, doi. 10.1007/s00214-010-0843-2

By:

Faza, Olalla;
Rodríguez, Roi;
López, Carlos

Publication type:

Article

On the mechanism of the Au(I)‐mediated addition of alkynes to anthranils to furnish 7‐acylindoles.

Published in:

Journal of Physical Organic Chemistry, 2022, v. 35, n. 11, p. 1, doi. 10.1002/poc.4333

By:

Stylianakis, Ioannis;
Litinas, Iraklis;
Nieto Faza, Olalla;
Kolocouris, Antonios;
Silva López, Carlos

Publication type:

Article

Assessing the attractive/repulsive force balance in axial cyclohexane C-Hax···Yax contacts: A combined computational analysis in monosubstituted cyclohexanes.

Published in:

Journal of Computational Chemistry, 2016, v. 37, n. 30, p. 2647, doi. 10.1002/jcc.24496

By:

Silva Lopez, Carlos;
Nieto Faza, Olalla;
De Proft, Frank;
Kolocouris, Antonios

Publication type:

Article

Corrigendum: Synthesis of Diverse Indole-Containing Scaffolds by Gold(I)-Catalyzed Tandem Reactions of 3-Propargylindoles Initiated by 1,2-Indole Migrations: Scope and Computational Studies.

Published in:

Chemistry - A European Journal, 2011, v. 17, n. 47, p. 13117, doi. 10.1002/chem.201103118

By:

Sanz, Roberto;
Miguel, Delia;
Gohain, Mukut;
García-García, Patricia;
Fernández-Rodríguez, Manuel A.;
González-Pérez, Adán;
Nieto-Faza, Olalla;
de Lera, Ángel R.;
Rodríguez, Félix

Publication type:

Article

Synthesis of Diverse Indole-Containing Scaffolds by Gold(I)-Catalyzed Tandem Reactions of 3-Propargylindoles Initiated by 1,2-Indole Migrations: Scope and Computational Studies.

Published in:

Chemistry - A European Journal, 2010, v. 16, n. 32, p. 9818, doi. 10.1002/chem.201001162

By:

Sanz, Roberto;
Miguel, Delia;
Gohain, Mukut;
García-García, Patricia;
Fernández-Rodríguez, Manuel A.;
González-Pérez, Adán;
Nieto-Faza, Olalla;
de Lera, Ángel R.;
Rodríguez, Félix

Publication type:

Article

Regio-, Peri-, and Torquoselectivity in Hydroxy Heptatrienyl Cation Electrocyclizations: The Iso/Homo-Nazarov Reaction.

Published in:

Chemistry - A European Journal, 2009, v. 15, n. 8, p. 1944, doi. 10.1002/chem.200801133

By:

Faza, Olalla Nieto;
López, Carlos Silva;
Álvarez, Rosana;
de Lera, Ángel R.

Publication type:

Article

Electrocyclic Ring Opening of cis-Bicyclo[ m.n.0]alkenes: The Anti-Woodward-Hoffmann Quest.

Published in:

Chemistry - A European Journal, 2007, v. 13, n. 17, p. 5009, doi. 10.1002/chem.200601151

By:

Silva López, Carlos;
Nieto Faza, Olalla;
de Lera, Ángel R.

Publication type:

Article

Exploring the Reactivity of α-Lithiated Aryl Benzyl Ethers: Inhibition of the [1,2]-Wittig Rearrangement and the Mechanistic Proposal Revisited.

Published in:

Chemistry - A European Journal, 2016, v. 22, n. 42, p. 15058, doi. 10.1002/chem.201602254

By:

Velasco, Rocío;
Silva López, Carlos;
Nieto Faza, Olalla;
Sanz, Roberto

Publication type:

Article

Normal-to-Abnormal NHC Rearrangement of AlIII, GaIII, and InIII Trialkyl Complexes: Scope, Mechanism, Reactivity Studies, and H2 Activation.

Published in:

Chemistry - A European Journal, 2015, v. 21, n. 49, p. 17959, doi. 10.1002/chem.201503000

By:

Schnee, Gilles;
Nieto Faza, Olalla;
Specklin, David;
Jacques, Béatrice;
Karmazin, Lydia;
Welter, Richard;
Silva López, Carlos;
Dagorne, Samuel

Publication type:

Article

Brønsted Acid-Catalyzed Cascade Reactions Involving 1,2-Indole Migration.

Published in:

Chemistry - A European Journal, 2015, v. 21, n. 37, p. 12889, doi. 10.1002/chem.201502174

By:

Álvarez, Estela;
Nieto Faza, Olalla;
Silva López, Carlos;
Fernández-Rodríguez, Manuel A.;
Sanz, Roberto

Publication type:

Article

Bis( o-methylserotonin)-containing iridium(III) and ruthenium(II) complexes as new cellular imaging dyes: synthesis, applications, and photophysical and computational studies.

Published in:

Journal of Biological Inorganic Chemistry (JBIC), 2013, v. 18, n. 6, p. 679, doi. 10.1007/s00775-013-1013-5

By:

Núñez, Cristina;
Silva López, Carlos;
Faza, Olalla;
Fernández-Lodeiro, Javier;
Diniz, Mario;
Bastida, Rufina;
Capelo, Jose;
Lodeiro, Carlos

Publication type:

Article

Pseudopericyclic design drives antara-antara [1,5] methylene sigmatropic shifts from a stepwise to a concerted mechanism.

Published in:

Journal of Computational Chemistry, 2007, v. 28, n. 8, p. 1411, doi. 10.1002/jcc.20620

By:

López, Carlos Silva;
Faza, Olalla Nieto;
Souto, José A.;
Álvarez, Rosana;
De Lera, Ángel R.

Publication type:

Article

Computation of vertical excitation energies of retinal and analogs: Scope and limitations.

Published in:

Journal of Computational Chemistry, 2006, v. 27, n. 1, p. 116, doi. 10.1002/jcc.20305

By:

López, Carlos Silva;
Faza, Olalla Nieto;
Estévez, Susana López;
De Lera, Angel R.

Publication type:

Article

Enantioselective CO2 Fixation Via a Heck‐Coupling/Carboxylation Cascade Catalyzed by Nickel.

Published in:

Chemistry - A European Journal, 2021, v. 27, n. 28, p. 7657, doi. 10.1002/chem.202101082

By:

Cerveri, Alessandro;
Giovanelli, Riccardo;
Sella, Davide;
Pedrazzani, Riccardo;
Monari, Magda;
Nieto Faza, Olalla;
López, Carlos Silva;
Bandini, Marco

Publication type:

Article

Gold-Photoredox-Cocatalyzed Tandem Oxycyclization/Coupling Sequence of Allenols and Diazonium Salts with Visible Light Mediation.

Published in:

Advanced Synthesis & Catalysis, 2017, v. 359, n. 16, p. 2789, doi. 10.1002/adsc.201700598

By:

Alcaide, Benito;
Almendros, Pedro;
Aparicio, Borja;
Lázaro ‐ Milla, Carlos;
Luna, Amparo;
Faza, Olalla Nieto

Publication type:

Article

Deciphering Nitroaromatics Reduction: Theoretical Insights into Dioxomolybdenum Catalysis with Biomass‐Derived Pinacol.

Published in:

ChemCatChem, 2024, v. 16, n. 9, p. 1, doi. 10.1002/cctc.202301575

By:

Kiriakidi, Sofia;
Silva López, Carlos;
Sanz, Roberto;
Faza, Olalla Nieto

Publication type:

Article

Torquoselectivity in the electrocyclic ring-opening of cyclopropyl anions.

Published in:

Journal of Physical Organic Chemistry, 2009, v. 22, n. 5, p. 378, doi. 10.1002/poc.1455

By:

Faza, Olalla Nieto;
López, Carlos Silva;
González-Pérez, Adán B.;
Pérez-Rodríguez, Martín;
de Lera, Ángel Rodríguez

Publication type:

Article

Works by Faza, Olalla

Pseudorotation of Natural and Chemically Modified Biological Phosphoranes: Implications for RNA Catalysis.

Pseudorotation of Natural and Chemically Modified Biological Phosphoranes: Implications for RNA Catalysis.

On the Use of Popular Basis Sets: Impact of the Intramolecular Basis Set Superposition Error.

Copper-Catalyzed Skeletal Rearrangement of O-Propargyl Oximes: A Mechanistic Manifold.

The Outer-Sphere Mechanism of Nitrene Transfer onto Gold(I) Alkyne Complexes.

Pseudorotation Barriers of Biological Oxyphosphoranes: A Challenge for Simulations of Ribozyme Catalysis.

Ellipticity: A Convenient Tool To Characterize Electrocyclic Reactions.

Theoretical Study of the Electrocyclic Ring Closure of Hydroxypentadienyl Cations.

Performance of density functional theory on homogeneous gold catalysis.

On the mechanism of the Au(I)‐mediated addition of alkynes to anthranils to furnish 7‐acylindoles.

Assessing the attractive/repulsive force balance in axial cyclohexane C-H<sub>ax</sub>···Y<sub>ax</sub> contacts: A combined computational analysis in monosubstituted cyclohexanes.

Corrigendum: Synthesis of Diverse Indole-Containing Scaffolds by Gold(I)-Catalyzed Tandem Reactions of 3-Propargylindoles Initiated by 1,2-Indole Migrations: Scope and Computational Studies.

Synthesis of Diverse Indole-Containing Scaffolds by Gold(I)-Catalyzed Tandem Reactions of 3-Propargylindoles Initiated by 1,2-Indole Migrations: Scope and Computational Studies.

Regio-, Peri-, and Torquoselectivity in Hydroxy Heptatrienyl Cation Electrocyclizations: The Iso/Homo-Nazarov Reaction.

Electrocyclic Ring Opening of cis-Bicyclo[ m.n.0]alkenes: The Anti-Woodward-Hoffmann Quest.

Exploring the Reactivity of α-Lithiated Aryl Benzyl Ethers: Inhibition of the [1,2]-Wittig Rearrangement and the Mechanistic Proposal Revisited.

Normal-to-Abnormal NHC Rearrangement of Al<sup>III</sup>, Ga<sup>III</sup>, and In<sup>III</sup> Trialkyl Complexes: Scope, Mechanism, Reactivity Studies, and H<sub>2</sub> Activation.

Brønsted Acid-Catalyzed Cascade Reactions Involving 1,2-Indole Migration.

Bis( o-methylserotonin)-containing iridium(III) and ruthenium(II) complexes as new cellular imaging dyes: synthesis, applications, and photophysical and computational studies.

Pseudopericyclic design drives antara-antara [1,5] methylene sigmatropic shifts from a stepwise to a concerted mechanism.

Computation of vertical excitation energies of retinal and analogs: Scope and limitations.

Enantioselective CO<sub>2</sub> Fixation Via a Heck‐Coupling/Carboxylation Cascade Catalyzed by Nickel.

Gold-Photoredox-Cocatalyzed Tandem Oxycyclization/Coupling Sequence of Allenols and Diazonium Salts with Visible Light Mediation.

Deciphering Nitroaromatics Reduction: Theoretical Insights into Dioxomolybdenum Catalysis with Biomass‐Derived Pinacol.

Torquoselectivity in the electrocyclic ring-opening of cyclopropyl anions.