Publications

2009 2008 2007 2006 2005 2004

2009

Lahoz, I.R., Sicre, C., Navarro-Vázquez, A., Silva López, C., Cid, M.
Mechanistic Investigation on the Formation of Indolizines from 2-Enynylpyridines
Organic Letters 2009, 11, 4802-4805
Feldman, K.S., Hester, D.K., Iyer, M.R., Munson, P.J., Silva López, C., Faza, O.N.
Allenyl Azide Cycloaddition Chemistry. 2,3-Cyclopentennelated Indole Synthesis through Indolidene Intermediates
Journal of Organic Chemistry 2009, 74, 4958-4974
Faza, O.N., Silva López, C., González-Pérez, A.B., Pérez-Rodríguez, M., De Lera, A.R.
Torquoselectivity in the electrocyclic ring-opening of cyclopropyl anions
Journal of Physical Organic Chemistry 2009, 22, 378-385
Pérez, A.G., Silva López, C., Marco-Contelles, J., Faza, O.N., Soriano, E., De Lera, A.R.
Mechanism of the gold-catalyzed rearrangement of (3-acyloxyprop-1-ynyl) oxiranes: A dual role of the catalyst
Journal of Organic Chemistry 2009, 74, 2982-2991
Silva López, C., Faza, O.N., De Lera, A.R.
Electrocyclic ring opening of charged cis-bicyclo[3.2.0]heptadiene and heterocyclic derivatives. the anti-Woodward-Hoffmann quest (II)
Journal of Organic Chemistry 2009, 74, 2396-2402
Faza, O.N., Silva López, C., Alvarez, R., De Lera, A.R.
Regio-, peri-, and torquoselectivity in hydroxy heptatrienyl cation electrocyclizations: The iso/homo-nazarov reaction
Chemistry - A European Journal 2009, 15, 1944-195 6
Silva López, C., Alvarez, R., Domínguez, M., Faza, O.N., De Lera, A.R.
Complex thermal behavior of 11-cis-retinal, the ligand of the visual pigments
Journal of Organic Chemistry 2009, 74, 1007-1013

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2008

Feldman, K.S., Iyer, M.R., Silva López, C., Faza, O.N.
Allenyl azide cycloaddition chemistry: Exploration of the scope and mechanism of cyclopentennelated dihydropyrrole synthesis th rough azatrimethylenemethane intermediates
Journal of Organic Chemistry 2008, 73, 5090-5099
Feldman II, K.S., Hester, D.K., Silva López, C., Faza, O.N.
Allenl azide cycloaddtion chemistry. Photochemical initiation and cul mediation leads to improved regioselectivity
Organic Letters 2008, 10, 1665-1668
Lee, T.-S., Silva López, C., Giambasu, G.M., Martick, M., Scott, W.G., York, D.M.
Role of Mg2+ in hammerhead ribozyme catalysis from molecular simulation
Journal of the American Chemical Society 2008, 130, 3053-3064
Silva López, C., Faza, O.N., De Lera, A.R.
Characterization of the switch in the mechanism of an intramolecular Diels-Alder reaction
Journal of Organic Chemistry 2008, 73, 467-473
Silva López, C., Pérez-Balado, C., Rodríguez-Graña, P., De Lera, A.R.
Mechanistic insights into the stereocontrolled synthesis of hexahydropyrrolo[2,3-b]indoles by electrophilic activation of tryptophan derivatives
Organic Letters 2008, 10, 77-80

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2007

Silva López, C., Faza, O.N., Feldman, K.S., Iyer, M.R., Hester, D.K.
Cyclization cascade of allenyl azides: A dual mechanism
Journal of the American Chemical Society 2007, 129, 7638-7646
Silva López, C., Faza, O.N., De Lera, A.R.
Electrocyclic ring opening of cis-bicyclo[m.n.0]alkenes: The anti-woodward-hoffmann quest
Chemistry - A European Journal 2007, 13, 5009-5017
Silva López, C., Faza, O.N., Souto, J.A., Alvarez, R., De Lera, A.R.
Pseudopericyclic design drives antara-antara [1,5] methylene sigmatropic shifts from a stepwise to a concerted mechanism
Journal of Computational Chemistry 2007, 28, 1411-1416
Faza, O.N., Silva López, C., De Lera, A.R.
Sulfoxide-induced stereoselection in [1,5]-sigmatropic hydrogen shifts of vinylallenes. A computational study
Journal of Organic Chemistry 2007, 72, 2617-2624
Lee, T.-S., Silva López, C., Martick, M., Scott, W.G., York, D.M.
Insight into the role of Mg2+ in hammerhead ribozyme catalysis from X-ray crystallography and molecular dynamics simulation
Journal of Chemical Theory and Computation 2007, 3, 325-327

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2006

Giese, T.J., Gregersen, B.A., Liu, Y., Nam, K., Mayaan, E., Moser, A., Range, K., Faza, O.N., Lopez, C.S., Lera, A.R.d., Schaftenaar, G., Lopez, X., Lee, T.-S., Karypis, G., York, D.M.
QCRNA 1.0: A database of quantum calculations for RNA catalysis
Journal of Molecular Graphics and Modelling 2006, 25, 423-433
Silva López, C., Faza, O.N., Alvarez, R., De Lera, A.R.
Cycloisomerization of activated (2E,4Z)-heptatrienoate and its relevance to crispatene (bio)synthesis. A case of concerted andstepwise uncertainty
Journal of Organic Chemistry 2006, 71, 4497-4501
Silva López, C., Faza, O.N., De Lera, A.R.
Computational study and analysis of the kinetic isotope effects of the rearrangement of cis-bicyclo[4.2.0]oct-7-ene to cis,cis- cycloocta-1,3-diene
Organic Letters 2006, 8, 2055-2058
Nieto Faza, O., Silva López, C., Alvarez, R., De Lera, A.R.
Mechanism of the gold(I)-catalyzed Rautenstrauch rearrangement: A center-to-helix-to-center chirality transfer
Journal of the American Chemical Society 2006, 128, 2434-2437
Range, K., Silva López, C., Moser, A., York, D.M.
Multilevel and density functional electronic structure calculations of proton affinities and gas-phase basicities involved in biological phosphoryl transfer
Journal of Physical Chemistry A 2006, 110, 791-797
Silva López, C., Faza, O.N., Estévez, S.L., De Lera, A.R.
Computation of vertical excitation energies of retinal and analogs: Scope and limitations
Journal of Computational Chemistry 2006, 27, 116-123
Alvarez, R., Faza, O.N., Silva López, C., De Lera, A.R.
Computational characterization of a complete palladium-catalyzed cross-coupling process: The associative transmetalation in the Stille reaction
Organic Letters 2006, 8, 35-38

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2005

López, S., Rodríguez, V., Montenegro, J., Saá, C., Alvarez, R., Silva López, C., De Lera, A.R., Simón, R., Lazarova, T., Padrós, E.
Synthesis of N-heteroaryl retinals and their artificial bacteriorhodopsins
ChemBioChem 2005, 6, 2078-2087
Faza, O.N., Silva López, C., Alvarez, R., De Lera, A.R.
Mechanistic subtleties in the cyclopentannelation of allenolate allyl carbamates: The origin of the center-to-center chirality transfer
Chemical Communications 2005, , 4285-4287
Lopez, C.S., Alvarez, R., Vaz, B., Faza, O.N., De Lera, A.R.
Simple diastereoselectivity of the BF₃·OEt₂-catalyzed vinylogous Mukaiyama aldol reaction of 2-(trimethylsiloxy)furans with aldehydes
Journal of Organic Chemistry 2005, 70, 3654-3659
Souto, J.A., Silva López, C., Faza, O.N., Alvarez, R., De Lera, A.R.
2-Alkylidenesulfol-3-enes by (regio- and) stereoselective cheletropic addition of SO2 to (di)vinylallenes
Organic Letters 2005, 7, 1565-1568
Silva López, C., Faza, O.N., De Lera, A.R., York, D.M.
Pseudorotation barriers of biological oxyphosphoranes: A challenge for simulations of ribozyme catalysis
Chemistry - A European Journal 2005, 11, 2081-2093
Silva López, C., Nieto Faza, O., Cossio, F.P., York, D.M., De Lera, A.R.
Ellipticity: A convenient tool to characterize electrocyclic reactions
Chemistry - A European Journal 2005, 11, 1734-1738

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2004

Nieto Faza, O., Silva López, C., Alvarez, R., De Lera, A.R.
Solvolytic ring-opening reactions of cyclopropyl bromides. An assessment of the Woodward-Hoffmann-DePuy rule
Journal of Organic Chemistry 2004, 69, 9002-9010
Nieto Faza, O., Silva López, C., Alvarez, R., De Lera, A.R.
Theoretical study of the electrocyclic ring closure of hydroxypentadienyl cations
Chemistry - A European Journal 2004, 10, 4324-4333
Silva López, C., Nieto Faza, O., Gregersen, B.A., Lopez, X., De Lera, A.R., York, D.M.
Pseudorotation of natural and chemically modified biological phosphoranes: Implications for RNA catalysis
ChemPhysChem 2004, 5, 1045-1049
Silva López, C., Nieto Faza, O., York, D.M., De Lera, A.R.
Theoretical study of the vinyl allene oxide to cyclopent-2-en-1-one rearrangement: Mechanism, torquoselectivity and solvent effects
Journal of Organic Chemistry 2004, 69, 3635-3644
Faza, O.N., Silva López, C., Alvarez, R., De Lera, A.R.
Conrotatory ring-opening reactions of cyclopropyl anions in monocyclic and tricyclic systems
Organic Letters 2004, 6, 901-904
Faza, O.N., Silva López, C., Alvarez, R., De Lera, A.R.
The Woodward-Hoffmann-De Puy rule revisited
Organic Letters 2004, 6, 905-908

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