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Neutron Crystallography Data Collection and Processing for Modelling Hydrogen Atoms in Protein Structures
Published on: December 1, 2020
6-Aminofulvene-1-aldimine: A Model Molecule for the Study of Intramolecular Hydrogen Bonds
Rosa María Claramunt1, Dionísia Sanz1, Sergio Hugo Alarcón1
1Departamento de Química Orgánica y Biología Facultad de Ciencias, UNED Senda del Rey 9, 28040 Madrid (Spain) Fax: (+34) 91-398-6697.
Abstract:
An unusually substantial coupling is observed across the hydrogen bond of fully 15 N-labeled compound 1 when it is studied by 1 H and 15 N NMR spectroscopy. The structure was determined by X-ray diffraction and shown to correspond to tautomer 1 a (both in the solid state and in solution). These results open up a new field of hydrogen-bond research by NMR spectroscopic methods.
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