75460 20210820090344.0 doi 10.3390/molecules23092278 sideral 108151 ART-2018-108151 eng Martinez-Felipe, A. Molecular recognition via hydrogen bonding in supramolecular complexes: A Fourier transform infrared spectroscopy study 2018 Access copy available to the general public Unrestricted We assess the assembly of supramolecular complexes by hydrogen bonding between azocompounds and a diacylaminopyridine monomer by temperature-dependent Fourier transform infrared spectroscopy (FT-IR) and density functional theory (DFT) calculations. The electronic delocalisation in the supramolecular rings formed by multiple hydrogen bonds stabilises the complexes, which coexist with dimeric species in temperature-dependent equilibria. We show how the application of readily available molecular modelling and spectroscopic techniques can predict the stability of new supramolecular entities coexisting in equilibria, ultimately assessing the success of molecular recognition. info:eu-repo/grantAgreement/ES/MINECO/MAT2017-84838-P info:eu-repo/semantics/openAccess by http://creativecommons.org/licenses/by/3.0/es/ 3.06 2018 CHEMISTRY, MULTIDISCIPLINARY 67 / 172 = 0.39 2018 Q2 T2 BIOCHEMISTRY & MOLECULAR BIOLOGY 133 / 294 = 0.452 2018 Q2 T2 0.757 2018 Analytical Chemistry 2018 Q1 Chemistry (miscellaneous) 2018 Q1 Drug Discovery 2018 Q1 Physical and Theoretical Chemistry 2018 Q1 Molecular Medicine 2018 Q1 Organic Chemistry 2018 Q1 Pharmaceutical Science 2018 Q1 Medicine (miscellaneous) 2018 Q1 info:eu-repo/semantics/article info:eu-repo/semantics/publishedVersion Brebner, F. Zaton, D. Concellon, A. Universidad de Zaragoza (orcid)0000-0002-8932-9085 Ahmadi, S. Piñol, M. Universidad de Zaragoza (orcid)0000-0001-5556-2172 Oriol, L. Universidad de Zaragoza (orcid)0000-0002-0922-5615 2013 765 Universidad de Zaragoza Dpto. Química Orgánica Área Química Orgánica 23, 9 (2018), 2278 [10 pp] Molecules Molecules 1420-3049 649746 http://zaguan.unizar.es/record/75460/files/texto_completo.pdf Versión publicada 106770 http://zaguan.unizar.es/record/75460/files/texto_completo.jpg?subformat=icon icon Versión publicada oai:zaguan.unizar.es:75460 articulos driver 2021-08-20-08:37:12 ARTICLE