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Here we report the IR spectra of FeEnterobactin in catecholate conformations ([CatFeEB]3−) obtained by DFT calculations using PBE/QZVP and their correlation it with its experimental counterpart [SalH3FeEB]0. Fragments of FeEnterobactin and Enterobactin (H6EB) are elucidated from their MALDI-TOF m...


Moreno, M.Zacarias, A.Velasquez, L.Gonzalez, G.Alegría-Arcos, M.Gonzalez-Nilo, F.Gross, E.K.U.[Experimental and theoretical structural/spectroscopical correlation of enterobactin and catecholamide]Experimental and theoretical structural/spectroscopical correlation of enterobactin and catecholamide

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