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Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
closedAccess | | 1994 | Imidazole and benzimidazole addition to quinones. Formation of meso and d,l isomers and crystal structure of the d,l isomer of 2,3-Bis(benzimidazol-1'-yl)-1,4-dihydroxybenzene | Escolástico, Consuelo; Santa María, María Dolores; Claramunt, Rosa M.; Jimeno, M. Luisa CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Foces-Foces, Concepción CSIC; Cano, Félix H.; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2012 | Influence of hydrogen bonds on the P⋯P pnicogen bond | Alkorta, Ibon CSIC ORCID ; Sánchez-Sanz, Goar CSIC ORCID; Elguero, José CSIC ORCID; Bene, J. E. del | artículo |
openAccess | | 2023 | Influence of Lewis acids on the symmetric SN2 reaction | Iribarren, I.; Trujillo, Cristina CSIC ORCID; Sánchez-Sanz, Goar CSIC ORCID; Hénon, E.; Elguero, José CSIC ORCID; Alkorta, Ibon CSIC ORCID | artículo |
closedAccess | | 2014 | Influence of substituent effects on the formation of P⋯Cl pnicogen bonds or halogen bonds | Del Bene, Janet E.; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2010 | Influence of the basis set on the calculation of the absolute 13C shieldings of methyl derivatives (CH3X with X = CH3, CN, NH2, NO2, OH, F) with special emphasis in the cases of X = Cl, Br, SH, SeH, and PH2 | Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
openAccess | | 2020 | Interaction between Trinuclear Regium Complexes of Pyrazolate and Anions, a Computational Study | Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Trujillo, Cristina CSIC ORCID; Sánchez-Sanz, Goar CSIC ORCID | artículo |
closedAccess | | 2005 | Interaction energies and NMR indirect nuclear spin-spin coupling constants in linear HCN and HNC complexes | Provasi, Patricio F.; Aucar, G. A.; Sánchez, M.; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Sauer, Stephan P. A. | artículo |
closedAccess | | 2016 | Interaction of beryllium derivatives with N-methylated DNA bases: 9-methylguanine and 1-methylcytosine | Marín-Luna, Marta CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2019 | Interaction of N-Heterocyclic Carbenes and Simple Carbenes with Small Molecules (One to Three Atoms) Excluding Metals: Formation of Covalent C–X Bonds | Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2008 | Interaction of positively and negatively charged aromatic hydrocarbons with benzene and triphenylene: Towards a model of pure organic insulators | Quiñonero, D.; Frontera, Antonio; Deyà, P. M.; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2013 | Intermolecular spin-spin coupling constants between 31P atoms | Sanz, David CSIC; Claramunt, Rosa M.; Mathey, F.; Alkorta, Ibon CSIC ORCID ; Sánchez-Sanz, Goar CSIC ORCID; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2012 | Intermolecular weak interactions in HTeXH dimers (X=O, S, Se, Te): Hydrogen bonds, chalcogen-chalcogen contacts and chiral discrimination | Sánchez-Sanz, Goar CSIC ORCID; Trujillo, Cristina CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
openAccess | | 2015 | Interplay between beryllium bonds and anion-π interactions in BeR<inf>2</inf>:C<inf>6</inf>X<inf>6</inf>:Y. Complexes (R = H, F and Cl, X = H and F, and y = Cl and Br) | Marín-Luna, Marta CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID; Mó, Otilia CSIC ORCID; Yáñez, Manuel | artículo |
closedAccess | | 2012 | Interplay of F-H ...F hydrogen bonds and P ...N pnicogen bonds | Del Bene, Janet E.; Alkorta, Ibon CSIC ORCID ; Sánchez-Sanz, Goar CSIC ORCID; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2018 | Intramolecular magnesium bonds in malonaldehyde-like systems: a critical view of the resonance-assisted phenomena | Sanz, Pablo; Montero-Campillo, M. Merced CSIC ORCID; Mó, Otilia CSIC ORCID; Yáñez, Manuel; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2013 | Intramolecular pnicogen interactions in PHF-(CH2) n-PHF (n=2-6) systems | Sánchez-Sanz, Goar CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Trujillo, Cristina CSIC ORCID; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2014 | Intramolecular pnicogen interactions in phosphorus and arsenic analogues of proton sponges | Sánchez-Sanz, Goar CSIC ORCID; Trujillo, Cristina CSIC ORCID; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2008 | Inverse hydrogen bonds between XeH2 and hydride and fluoride derivatives of Li, Be, Na and Mg | Blanco, Fernando CSIC; Solimannejad, Mohammad; Elguero, José CSIC ORCID | artículo |
openAccess | | 2021 | IR and NMR properties of N-base:PH2F:BeX2 ternary and corresponding binary complexes stabilised by pnicogen and beryllium bonds | Del Bene, Janet E.; Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |
closedAccess | | 2017 | Is it possible to use the 31P chemical shifts of phosphines to measure hydrogen bond acidities (HBA)? A comparative study with the use of the 15N chemical shifts of amines for measuring HBA | Alkorta, Ibon CSIC ORCID ; Elguero, José CSIC ORCID | artículo |