1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate
The title compound, C28H24N4O4·H2O, crystallizes with two organic molecules and two solvent water molecules in the asymmetric unit. The most obvious difference between the molecules is the torsion angles between the isoxazole ring and the benzene and phenyl rings [47.0 (2)...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2011-01-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536810052463 |
| _version_ | 1818907594768515072 |
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| author | Iván Brito Alejandro Cárdenas Carlos Fernández Margarita Gutierrez Gabriel Vallejos |
| author_facet | Iván Brito Alejandro Cárdenas Carlos Fernández Margarita Gutierrez Gabriel Vallejos |
| author_sort | Iván Brito |
| collection | DOAJ |
| description | The title compound, C28H24N4O4·H2O, crystallizes with two organic molecules and two solvent water molecules in the asymmetric unit. The most obvious difference between the molecules is the torsion angles between the isoxazole ring and the benzene and phenyl rings [47.0 (2)/56.4 (2) and 33.3 (2)/11.0 (2)°, respectively]. Another important difference is observed in the rotation of the nitro group with respect to the phenyl groups [3.5 (6) and 31.1 (6)°]. The pyrrolidinone fragment is cis oriented with respect to the 4-nitrophenyl fragment. In the crystal, molecules are linked into centrosymmetric R42(8) and R44(20) motifs by O—H...O and N—H...O interactions. |
| first_indexed | 2024-12-19T21:57:37Z |
| format | Article |
| id | doaj.art-2aa35436e48641d6ac0fc9f4d8f2b93a |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-19T21:57:37Z |
| publishDate | 2011-01-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-2aa35436e48641d6ac0fc9f4d8f2b93a2022-12-21T20:04:14ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-01-01671o175o17610.1107/S16005368100524631-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrateIván BritoAlejandro CárdenasCarlos FernándezMargarita GutierrezGabriel VallejosThe title compound, C28H24N4O4·H2O, crystallizes with two organic molecules and two solvent water molecules in the asymmetric unit. The most obvious difference between the molecules is the torsion angles between the isoxazole ring and the benzene and phenyl rings [47.0 (2)/56.4 (2) and 33.3 (2)/11.0 (2)°, respectively]. Another important difference is observed in the rotation of the nitro group with respect to the phenyl groups [3.5 (6) and 31.1 (6)°]. The pyrrolidinone fragment is cis oriented with respect to the 4-nitrophenyl fragment. In the crystal, molecules are linked into centrosymmetric R42(8) and R44(20) motifs by O—H...O and N—H...O interactions.http://scripts.iucr.org/cgi-bin/paper?S1600536810052463 |
| spellingShingle | Iván Brito Alejandro Cárdenas Carlos Fernández Margarita Gutierrez Gabriel Vallejos 1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate Acta Crystallographica Section E |
| title | 1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate |
| title_full | 1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate |
| title_fullStr | 1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate |
| title_full_unstemmed | 1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate |
| title_short | 1-[2-(4-Nitrophenyl)-5-(5-phenyl-1,2-oxazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]pyrrolidin-2-one monohydrate |
| title_sort | 1 2 4 nitrophenyl 5 5 phenyl 1 2 oxazol 3 yl 1 2 3 4 tetrahydroquinolin 4 yl pyrrolidin 2 one monohydrate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536810052463 |
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