1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one
The asymmetric unit of the title compound, C9H6BrN3O3, consists of two independent molecules differing in the rotational orientations of the nitro and acetyl substituents. In the crystal, head-to-head π-stacking between pairs of adjacent molecules forms dimers which are associated into stacks by C—B...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2017-05-01
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| Series: | IUCrData |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314617006605 |
| _version_ | 1818318700670877696 |
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| author | Mohamed Mokhtar Mohamed Abdelahi Youness El Bakri Mohamed Said Minnih Mohammed Benchidmi El Mokhtar Essassi Joel T. Mague |
| author_facet | Mohamed Mokhtar Mohamed Abdelahi Youness El Bakri Mohamed Said Minnih Mohammed Benchidmi El Mokhtar Essassi Joel T. Mague |
| author_sort | Mohamed Mokhtar Mohamed Abdelahi |
| collection | DOAJ |
| description | The asymmetric unit of the title compound, C9H6BrN3O3, consists of two independent molecules differing in the rotational orientations of the nitro and acetyl substituents. In the crystal, head-to-head π-stacking between pairs of adjacent molecules forms dimers which are associated into stacks by C—Br...π(ring) interactions. C—H...O hydrogen bonds tie the stacks together. |
| first_indexed | 2024-12-13T09:57:23Z |
| format | Article |
| id | doaj.art-022e71b4b03d4c0fb969e6da07c98833 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-13T09:57:23Z |
| publishDate | 2017-05-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-022e71b4b03d4c0fb969e6da07c988332022-12-21T23:51:45ZengInternational Union of CrystallographyIUCrData2414-31462017-05-0125x17066010.1107/S2414314617006605ff40171-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-oneMohamed Mokhtar Mohamed Abdelahi0Youness El Bakri1Mohamed Said Minnih2Mohammed Benchidmi3El Mokhtar Essassi4Joel T. Mague5Laboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av Ibn Battouta, BP 1014, Faculté des Sciences, Mohammed V University, Rabat, MoroccoLaboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av Ibn Battouta, BP 1014, Faculté des Sciences, Mohammed V University, Rabat, MoroccoFaculté des Sciences et Techniques, Université de Sciences, de Technologie, et de Medecine Nouakchott, MauritaniaLaboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av Ibn Battouta, BP 1014, Faculté des Sciences, Mohammed V University, Rabat, MoroccoLaboratoire de Chimie Organique Hétérocyclique, URAC 21, Pôle de Compétence Pharmacochimie, Av Ibn Battouta, BP 1014, Faculté des Sciences, Mohammed V University, Rabat, MoroccoDepartment of Chemistry, Tulane University, New Orleans, LA 70118, USAThe asymmetric unit of the title compound, C9H6BrN3O3, consists of two independent molecules differing in the rotational orientations of the nitro and acetyl substituents. In the crystal, head-to-head π-stacking between pairs of adjacent molecules forms dimers which are associated into stacks by C—Br...π(ring) interactions. C—H...O hydrogen bonds tie the stacks together.http://scripts.iucr.org/cgi-bin/paper?S2414314617006605crystal structurehydrogen bondπ-stackingindazole |
| spellingShingle | Mohamed Mokhtar Mohamed Abdelahi Youness El Bakri Mohamed Said Minnih Mohammed Benchidmi El Mokhtar Essassi Joel T. Mague 1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one IUCrData crystal structure hydrogen bond π-stacking indazole |
| title | 1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one |
| title_full | 1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one |
| title_fullStr | 1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one |
| title_full_unstemmed | 1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one |
| title_short | 1-(3-Bromo-6-nitro-1H-indazol-1-yl)ethan-1-one |
| title_sort | 1 3 bromo 6 nitro 1h indazol 1 yl ethan 1 one |
| topic | crystal structure hydrogen bond π-stacking indazole |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314617006605 |
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