Crystal structure, Hirshfeld surface analysis and DFT study of N-(2-amino-5-methylphenyl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide

Crystal structure, Hirshfeld surface analysis and DFT study of N-(2-amino-5-methylphenyl)-2-(5-methyl-1H-pyrazol-3-yl)acetamide

The title molecule, C13H16N4O, adopts an angular conformation. In the crystal a layer structure is generated by N—H...O and N—H...N hydrogen bonds together with C—H...π(ring) interactions. Hirshfeld surface analysis indicates that the most important contributions to the crystal packing are from H......

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Bibliographic Details
Main Authors: Gamal Al Ati, Karim Chkirate, Joel T. Mague, Nadeem Abad, Redouane Achour, El Mokhtar Essassi
Format: Article
Language:English
Published: International Union of Crystallography 2021-06-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
pyrazolylacetamide
hydrogen bond
Online Access:http://scripts.iucr.org/cgi-bin/paper?S205698902100503X

Internet

http://scripts.iucr.org/cgi-bin/paper?S205698902100503X

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