Ferrer, M, Alkorta, I, Elguero, J, Oliva-Enrich, JM. Use of 5,10-Disubstituted Dibenzoazaborines and Dibenzophosphaborines as Cyclic Supports of Frustrated Lewis Pairs for the Capture of CO2. Chemphyschem. 2022;23 (18):e202200619. doi: 10.1002/cphc.202200619. PubMed PMID:36131592 .
JE Del Bene, I Alkorta, J Elguero. Probing C⋯ S chalcogen bonds in complexes SC: SHX, for X= NO2, NC, F, Cl, CN, CCH, and NH2
Chemical Physics Letters 2019, 721, 86-90
R Moladoust, MD Esrafili, A Hosseinian, I Alkorta, E Vessally. Adsorption sensitivity of pristine and Al- or Si-doped boron nitride nanoflake to COCl2: a DFT study
Molecular Physics 2019, 117 (5), 626-634
I Alkorta, AC Legon. Non-Covalent Interactions Involving Alkaline-Earth Atoms and Lewis Bases B: An ab Initio Investigation of Beryllium and Magnesium Bonds, B··· MR2 (M= Be or Mg, and R= H, F or CH3). Inorganics 2019, 7 (3), 35
GJ Clarkson, MÁ Farrán, RM Claramunt, I Alkorta, J Elguero. The structure of the anti-aging agent J147 used for treating Alzheimer’s disease. Acta Crystallographica Section C: Structural Chemistry 2019, 75 (3).
JE Bertolini, I Alkorta. Acidez geométrica y la última publicación de Josep Castells en Anales de Química. Anales de Química 2019, 115 (1), 22-25
E Gougoula, C Medcraft, I Alkorta, NR Walker, AC Legon. A chalcogen-bonded complex H3N center dot center dot center dot S= C= S formed by ammonia and carbon disulfide characterised by chirped-pulse, broadband microwave spectroscopy. J. Chem. Phys. 2019 150 (8)
E Gougoula, C Medcraft, I Alkorta, NR Walker, AC Legon. A chalcogen-bonded complex H3N⋯S=C=S formed by ammonia and carbon disulfide characterised by chirped-pulse, broadband microwave spectroscopy. The Journal of chemical physics 2019, 150 (8), 084307
I Alkorta, J Elguero. Interaction of N‐Heterocyclic Carbenes and Simple Carbenes with Small Molecules (One to Three Atoms) Excluding Metals: Formation of Covalent C–X Bonds. Journal of Heterocyclic Chemistry 2019, 56 (2), 359-370
N Salehi, L Edjlali, E Vessally, I Alkorta, M Es’ haghi. Lin@ Tetracyanoethylene (n= 1–4) systems: Lithium salt vs lithium electride. Computational and Theoretical Chemistry 2019, 1149, 17-23
I Alkorta, I Mata, E Molins, E Espinosa. Energetic, Topological and Electric Field Analyses of Cation‐Cation Nucleic Acid Interactions in Watson‐Crick Disposition.
ChemPhysChem 2019, 20 (1), 148-158