Crystal structure, computational study and Hirshfeld surface analysis of ethyl (2S,3R)-3-(3-amino-1H-1,2,4-triazol-1-yl)-2-hy­droxy-3-phenyl­propano­ate

In the title mol­ecule, C(13)H(16)N(4)O(3), the mean planes of the phenyl and triazole rings are nearly perpendicular to one another as a result of the intra­molecular C—H⋯O and C—H⋯π(ring) inter­actions. In the crystal, layers parallel to (101) are generated by O—H⋯N, N—H⋯O and N—H⋯N hydrogen bonds...

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Dades bibliogràfiques
Publicat a:Acta Crystallogr E Crystallogr Commun
Autors principals: Ben Ali, Abdelkader, El Bakri, Youness, Lai, Chin-Hung, Sebhaoui, Jihad, El Ghayati, Lhoussaine, Essassi, El Mokhtar, Mague, Joel T.
Format: Artigo
Idioma:Inglês
Publicat: International Union of Crystallography 2019
Matèries:
Research Communications
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC6895933/
https://ncbi.nlm.nih.gov/pubmed/31871758
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S2056989019015743
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