Publication: Molecular structure in the solid state by X-ray crystallography and SSNMR and in solution by NMR of two 1,4-diazepines
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Date
2017-10-23
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info:eu-repo/semantics/openAccess
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Elsevier
Abstract
The crystals of two 1,4-diazepines prepared from curcuminoid β-diketones and ethylenediamine were studied by X-ray crystallography and NMR. Their tautomerism, intramolecular hydrogen bonds and conformation were determined
Description
This is an Accepted Manuscript of an article published in “Journal of Molecular Structure, 1155, 205-214", is available online at the publisher's website: Elsevier, https://doi.org/10.1016/j.molstruc.2017.10.112
Este es el manuscrito aceptado del artículo publicado en “Journal of Molecular Structure, 1155, 205-214", disponible en línea en el sitio web del editor: Elsevier, https://doi.org/10.1016/j.molstruc.2017.10.112
Este es el manuscrito aceptado del artículo publicado en “Journal of Molecular Structure, 1155, 205-214", disponible en línea en el sitio web del editor: Elsevier, https://doi.org/10.1016/j.molstruc.2017.10.112
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Keywords
Diazepines, Curcumin, Rotational disorder, DFT calculations, GIAO
Citation
Nieto, C. I., Sanz, D., Claramunt, R. M., Torralba, M. C., Torres, M. R., Alkorta, I., & Elguero, J. (2018). Molecular structure in the solid state by X-ray crystallography and SSNMR and in solution by NMR of two 1,4-diazepines. Journal of Molecular Structure, 1155, 205-214. https://doi.org/10.1016/J.MOLSTRUC.2017.10.112
Center
Facultad de Ciencias
Department
Química Orgánica y Bio-Orgánica