5-Acetamido-1H-pyrazole-4-carboxamide monohydrate

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—...

Full description

Bibliographic Details
Main Authors: Lhoussaine El Ghayati, Youssef Ramli, El Mokhtar Essassi, Mohamed Labd Taha, Joel T. Mague
Format: Article
Language:English
Published: International Union of Crystallography 2016-06-01
Series:IUCrData
Subjects:
crystal structure
hydrogen bonding
pyrazole
carboxamide
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2414314616009470
id doaj-0f346fc06a7440d5827e65a7652a6e1d
record_format Article
spelling 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 AT lhoussaineelghayati 5acetamido1hpyrazole4carboxamidemonohydrate
AT yousseframli 5acetamido1hpyrazole4carboxamidemonohydrate
AT elmokhtaressassi 5acetamido1hpyrazole4carboxamidemonohydrate
AT mohamedlabdtaha 5acetamido1hpyrazole4carboxamidemonohydrate
AT joeltmague 5acetamido1hpyrazole4carboxamidemonohydrate
_version_ 1725572111113650176

Similar Items