5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one
The triazole ring in the title molecule, C9H10N4O, is not quite coplanar with the six-membered ring to which it is fused, the dihedral angle between the two least-squares planes being 2.52 (6)°. In the crystal, a layered structure is formed by N—H...N and C—H...O hydrogen bonds plus slipped π-stacki...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2023-05-01
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| Series: | IUCrData |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314623004091 |
| _version_ | 1797692283348320256 |
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| author | Walid Ettahiri Amal Dalbouha Abdesselam Baouid Abdulsalam Alsubari Joel T. Mague Mustapha Taleb Youssef Ramli |
| author_facet | Walid Ettahiri Amal Dalbouha Abdesselam Baouid Abdulsalam Alsubari Joel T. Mague Mustapha Taleb Youssef Ramli |
| author_sort | Walid Ettahiri |
| collection | DOAJ |
| description | The triazole ring in the title molecule, C9H10N4O, is not quite coplanar with the six-membered ring to which it is fused, the dihedral angle between the two least-squares planes being 2.52 (6)°. In the crystal, a layered structure is formed by N—H...N and C—H...O hydrogen bonds plus slipped π-stacking interactions, with the fused cyclohexene rings projecting to either side. |
| first_indexed | 2024-03-12T02:26:18Z |
| format | Article |
| id | doaj.art-bec5fe85a45c4c43acf2c7db821590b1 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-03-12T02:26:18Z |
| publishDate | 2023-05-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-bec5fe85a45c4c43acf2c7db821590b12023-09-05T13:04:45ZengInternational Union of CrystallographyIUCrData2414-31462023-05-0185x23040910.1107/S2414314623004091tk40915,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-oneWalid Ettahiri0Amal Dalbouha1Abdesselam Baouid2Abdulsalam Alsubari3Joel T. Mague4Mustapha Taleb5Youssef Ramli6Laboratory of Engineering, Electrochemistry, Modeling and Environment, Faculty of Sciences, Sidi Mohamed Ben Abdellah University, Fez, MoroccoLaboratory of Engineering, Electrochemistry, Modeling and Environment, Faculty of Sciences, Sidi Mohamed Ben Abdellah University, Fez, MoroccoLaboratory of Molecular Chemistry, Faculty of Sciences Semlalia, Cadi Ayyad University, Marrakech, MoroccoLaboratory of Medicinal Chemistry, Faculty of Clinical Pharmacy, 21 September University, YemenDepartment of Chemistry, Tulane University, New Orleans, LA 70118, USALaboratory of Engineering, Electrochemistry, Modeling and Environment, Faculty of Sciences, Sidi Mohamed Ben Abdellah University, Fez, MoroccoLaboratory of Medicinal Chemistry, Drug Sciences Research Center, Faculty of Medicine and Pharmacy, Mohammed V University in Rabat, MoroccoThe triazole ring in the title molecule, C9H10N4O, is not quite coplanar with the six-membered ring to which it is fused, the dihedral angle between the two least-squares planes being 2.52 (6)°. In the crystal, a layered structure is formed by N—H...N and C—H...O hydrogen bonds plus slipped π-stacking interactions, with the fused cyclohexene rings projecting to either side.http://scripts.iucr.org/cgi-bin/paper?S2414314623004091crystal structureπ-stackinghydrogen bondingtriazoletetrahydroquinazoline |
| spellingShingle | Walid Ettahiri Amal Dalbouha Abdesselam Baouid Abdulsalam Alsubari Joel T. Mague Mustapha Taleb Youssef Ramli 5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one IUCrData crystal structure π-stacking hydrogen bonding triazole tetrahydroquinazoline |
| title | 5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one |
| title_full | 5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one |
| title_fullStr | 5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one |
| title_full_unstemmed | 5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one |
| title_short | 5,6,7,8-Tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9(4H)-one |
| title_sort | 5 6 7 8 tetrahydro 1 2 4 triazolo 5 1 b quinazolin 9 4h one |
| topic | crystal structure π-stacking hydrogen bonding triazole tetrahydroquinazoline |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314623004091 |
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