Showing results 1 to 20 of 23
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| Rights | Preview | Issue Date | Title | Author(s) | Type |
| closedAccess |  | 2014 | A computational study on 3-azonia-,3-phosphonia-, and 3-arsoniaspiro [2.2] pentanes and related three-membered heterocycles | Trujillo, Cristina; Sánchez-Sanz, Goar; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2012 | A theoretical study of the parent NH-benzazoles (benzimidazoles, indazoles and benzotriazoles): Geometries, energies, acidity and basicity, NMR properties and molecular electrostatic potentials | Alkorta, Ibon CSIC ORCID ; Sánchez-Sanz, Goar; Trujillo, Cristina; Elguero, José CSIC ORCID; Claramunt, Rosa M. | artículo |
| closedAccess |  | 2013 | A theoretical study on the aromaticity of benzene and related derivatives incorporating a C-C≡C-C fragment Dedicated to Professor Ibon Alkorta on the occasion of his 50th anniversary | Sánchez-Sanz, Goar; Trujillo, Cristina; Rozas, Isabel; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2017 | An insight on the aromatic changes in closed shell icosagen, tetrel, and pnictogen phenalenyl derivatives | Trujillo, Cristina; Sánchez-Sanz, Goar; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2016 | Aromatic changes in isoelectronic derivatives of phenalenyl radicals by central carbon replacement | Sánchez-Sanz, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| openAccess | | 2015 | Bisimidazoline arylamides binding to the DNA minor groove: N1-hydroxylation enhances binding affinity and selectivity to AATT sites | Ríos Martínez, Carlos H. CSIC; Lagartera, Laura ORCID; Trujillo, Cristina; Dardonville, Christophe CSIC ORCID | artículo |
| closedAccess |  | 2016 | Competition between intramolecular hydrogen and pnictogen bonds in protonated systems | Sánchez-Sanz, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2015 | Computational Study of Proton Transfer in Tautomers of 3- and 5-Hydroxypyrazole Assisted by Water | Trujillo, Cristina; Sánchez-Sánchez, Goar; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| openAccess |  | 2019 | Cooperative effects in weak interactions: Enhancement of tetrel bonds by intramolecular hydrogen bonds | Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Sánchez-Sánchez, Goar | artículo |
| closedAccess |  | 2012 | Electron density shift description of non-bonding intramolecular interactions | Sánchez-Sanz, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2017 | Enhancing Intramolecular Chalcogen Interactions in 1-Hydroxy-8-YH-naphthalene Derivatives | Sánchez-Sánchez, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| openAccess | | 2021 | Evaluation of Electron Density Shifts in Noncovalent Interactions | Iribarren, Iñigo; Sánchez-Sanz, Goar; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Trujillo, Cristina | artículo |
| closedAccess |  | 2015 | Halogen, chalcogen and pnictogen interactions in (XNO<inf>2</inf>)<inf>2</inf> homodimers (X = F, Cl, Br, I) | Trujillo, Cristina; Sánchez-Sánchez, Goar; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2014 | Intramolecular pnicogen interactions in phosphorus and arsenic analogues of proton sponges | Sánchez-Sanz, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2019 | Modulating intramolecular chalcogen bonds in aromatic (thio)(seleno)phene-based derivatives | Trujillo, Cristina; Rozas, Isabel; Elguero, José CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Sanchez-Sanchez, Goar | artículo |
| closedAccess |  | 2016 | Modulating intramolecular P⋯N pnictogen interactions | Sánchez-Sánchez, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| closedAccess |  | 2013 | Non-covalent interactions: Complexes of guanidinium with DNA and RNA nucleobases | Blanco, Fernando; Kelly, Brendan; Sánchez-Sanchez, Goar; Trujillo, Cristina; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Rozas, Isabel | artículo |
| closedAccess |  | 2013 | Orthogonal interactions between nitryl derivatives and electron donors: Pnictogen bonds | Sánchez-Sanchez, Goar; Trujillo, Cristina; Solimannejad, Mohammad; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
| openAccess |  | 28-Jul-2021 | Reactivity of Coinage Metal Hydrides for the Production of H 2 Molecules | Iribarren, Iñigo; Sánchez-Sanz, Goar; Elguero, José CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Trujillo, Cristina | artículo |
| openAccess |  | 2020 | Regium Bonds between Silver(I) Pyrazolates Dinuclear Complexes and Lewis Bases (N2, OH2, NCH, SH2, NH3, PH3, CO and CNH) | Alkorta, Ibon CSIC ORCID ; Trujillo, Cristina; Sánchez-Sanz, Goar; Elguero, José CSIC ORCID | artículo |
