5-Acetamido-1H-pyrazole-4-carboxamide monohydrate
There are two independent molecules of the title carboxamide compound, C6H8N4O2·H2O, as well as two independent water molecules in the asymmetric unit. The two independent carboxamide molecules differ primarily in the relative orientations of the peripheral methyl and amino groups. Intramolecular N—...
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doaj-0f346fc06a7440d5827e65a7652a6e1d2020-11-24T23:21:14ZengInternational Union of CrystallographyIUCrData2414-31462016-06-0116x16094710.1107/S2414314616009470tk40155-Acetamido-1H-pyrazole-4-carboxamide monohydrateLhoussaine El Ghayati0Youssef Ramli1El Mokhtar Essassi2Mohamed Labd Taha3Joel T. Mague4Laboratoire de Chemie Bio Organique Appliquée, Faculté des Sciences, Université Ibn Zohr, Agadir, MoroccoLaboratory of Medicinal Chemistry, Faculty of Medicine and Pharmacy, University Mohammed V, Rabat, MoroccoLaboratoire de Chimie Organique Hétérocyclique URAC 21, Av. Ibn Battouta, BP 1014, Faculté des Sciences, Université Mohammed V, Rabat, MoroccoLaboratoire de Chemie Bio Organique Appliquée, Faculté des Sciences, Université Ibn Zohr, Agadir, MoroccoDepartment of Chemistry, Tulane University, New Orleans, LA 70118, USAThere are two independent molecules of the title carboxamide compound, C6H8N4O2·H2O, as well as two independent water molecules in the asymmetric unit. The two independent carboxamide molecules differ primarily in the relative orientations of the peripheral methyl and amino groups. Intramolecular N—H...O hydrogen bonds assist in determining the orientations of the acetamido substituents. The three-dimensional crystal packing is directed by a large network of O—H...O, N—H...O, C—H...O and C—H...N hydrogen bonds.http://scripts.iucr.org/cgi-bin/paper?S2414314616009470crystal structurehydrogen bondingpyrazolecarboxamide |
collection |
DOAJ |
language |
English |
format |
Article |
sources |
DOAJ |
author |
Lhoussaine El Ghayati Youssef Ramli El Mokhtar Essassi Mohamed Labd Taha Joel T. Mague |
spellingShingle |
Lhoussaine El Ghayati Youssef Ramli El Mokhtar Essassi Mohamed Labd Taha Joel T. Mague 5-Acetamido-1H-pyrazole-4-carboxamide monohydrate IUCrData crystal structure hydrogen bonding pyrazole carboxamide |
author_facet |
Lhoussaine El Ghayati Youssef Ramli El Mokhtar Essassi Mohamed Labd Taha Joel T. Mague |
author_sort |
Lhoussaine El Ghayati |
title |
5-Acetamido-1H-pyrazole-4-carboxamide monohydrate |
title_short |
5-Acetamido-1H-pyrazole-4-carboxamide monohydrate |
title_full |
5-Acetamido-1H-pyrazole-4-carboxamide monohydrate |
title_fullStr |
5-Acetamido-1H-pyrazole-4-carboxamide monohydrate |
title_full_unstemmed |
5-Acetamido-1H-pyrazole-4-carboxamide monohydrate |
title_sort |
5-acetamido-1h-pyrazole-4-carboxamide monohydrate |
publisher |
International Union of Crystallography |
series |
IUCrData |
issn |
2414-3146 |
publishDate |
2016-06-01 |
description |
There are two independent molecules of the title carboxamide compound, C6H8N4O2·H2O, as well as two independent water molecules in the asymmetric unit. The two independent carboxamide molecules differ primarily in the relative orientations of the peripheral methyl and amino groups. Intramolecular N—H...O hydrogen bonds assist in determining the orientations of the acetamido substituents. The three-dimensional crystal packing is directed by a large network of O—H...O, N—H...O, C—H...O and C—H...N hydrogen bonds. |
topic |
crystal structure hydrogen bonding pyrazole carboxamide |
url |
http://scripts.iucr.org/cgi-bin/paper?S2414314616009470 |
work_keys_str_mv |
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1725572111113650176 |