Supporting Information: Stereoselective, ruthenium-photocatalyzed synthesis of 1,2-diaminotruxinic bis-amino acids from 4-arylidene-5(4 H)-oxazolones

Figures for the Experimental Section (illustration of the setup utilized for in situ NMR experiments and continuous-flow reactions), control 1H NMR spectra of oxazolones 1, copies of 1H, 13C, and 19F NMR spectra for all new compounds 2 and 3, DP4 characterization of the μ-isomer, conversions (percen...

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Detalles Bibliográficos
Autores: Sierra, Sonia, Gómez, M. Victoria, Jiménez, Ana I., Pop, Alexandra, Silvestru, Cristian, Marín, María Luisa, Boscá, Francisco, Sastre, Germán, Gómez-Bengoa, Enrique, Urriolabeitia, Esteban P.
Tipo de recurso: conjunto de datos
Fecha de publicación:2022
País:España
Institución:Consejo Superior de Investigaciones Científicas (CSIC)
Repositorio:DIGITAL.CSIC. Repositorio Institucional del CSIC
OAI Identifier:oai:digital.csic.es:10261/330318
Acceso en línea:http://hdl.handle.net/10261/330318
Access Level:acceso abierto
Descripción
Sumario:Figures for the Experimental Section (illustration of the setup utilized for in situ NMR experiments and continuous-flow reactions), control 1H NMR spectra of oxazolones 1, copies of 1H, 13C, and 19F NMR spectra for all new compounds 2 and 3, DP4 characterization of the μ-isomer, conversions (percent) of oxazolones 1 to give cyclobutene-bis(oxazolones) 2 from two consecutive reactions in microreactors, copies of the absorption (UV–vis) spectra of (Z)-oxazolones 1 and selected (E)-oxazolones, quenching experiments, LFP experiments, cyclic voltammograms, and DFT calculations (optimized geometries and tables with absolute and relative energies) (PDF). Geometries: coordinates of all species calculated in Figure 11, using different functionals, basis and solvents (ZIP).