2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
The title molecule, C23H18ClN5O4S, is in an `extended' conformation. The central triazole ring makes dihedral angles of 58.14 (6), 86.29 (6) and 41.99 (6)°, respectively, with the adjacent phenyl, chlorophenyl and nitrophenyl rings. In the crystal, molecules are linked via a pair of N—H...N hyd...
| Main Authors: | , , , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2016-03-01
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| Series: | IUCrData |
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| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314616004521 |
| _version_ | 1818313486528151552 |
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| author | Joel T. Mague Shaaban K. Mohamed Mehmet Akkurt Gamal A.-W. Ahmed Etify A. Bakhite Mustafa R. Albayati |
| author_facet | Joel T. Mague Shaaban K. Mohamed Mehmet Akkurt Gamal A.-W. Ahmed Etify A. Bakhite Mustafa R. Albayati |
| author_sort | Joel T. Mague |
| collection | DOAJ |
| description | The title molecule, C23H18ClN5O4S, is in an `extended' conformation. The central triazole ring makes dihedral angles of 58.14 (6), 86.29 (6) and 41.99 (6)°, respectively, with the adjacent phenyl, chlorophenyl and nitrophenyl rings. In the crystal, molecules are linked via a pair of N—H...N hydrogen bonds with an R22(16) ring motif, forming an inversion dimer. The dimers are connected by C—H...O hydrogen bonds into a tape structure along [011]. C—H...π interactions between the tapes are also observed. |
| first_indexed | 2024-12-13T08:34:31Z |
| format | Article |
| id | doaj.art-29775b401c2842f18a8d5f727efcdf00 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-13T08:34:31Z |
| publishDate | 2016-03-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-29775b401c2842f18a8d5f727efcdf002022-12-21T23:53:41ZengInternational Union of CrystallographyIUCrData2414-31462016-03-0113x16045210.1107/S2414314616004521is40052-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamideJoel T. Mague0Shaaban K. Mohamed1Mehmet Akkurt2Gamal A.-W. Ahmed3Etify A. Bakhite4Mustafa R. Albayati5Department of Chemistry, Tulane University, New Orleans, LA 70118, USAChemistry and Environmental Division, Manchester Metropolitan University, Manchester M1 5GD, EnglandDepartment of Physics, Faculty of Sciences, Erciyes University, 38039 Kayseri, TurkeyChemistry Department, Faculty of Science, Assiut University, 71516 Assiut, EgyptChemistry Department, Faculty of Science, Assiut University, 71516 Assiut, EgyptKirkuk University, College of Science, Department of Chemistry, Kirkuk, IraqThe title molecule, C23H18ClN5O4S, is in an `extended' conformation. The central triazole ring makes dihedral angles of 58.14 (6), 86.29 (6) and 41.99 (6)°, respectively, with the adjacent phenyl, chlorophenyl and nitrophenyl rings. In the crystal, molecules are linked via a pair of N—H...N hydrogen bonds with an R22(16) ring motif, forming an inversion dimer. The dimers are connected by C—H...O hydrogen bonds into a tape structure along [011]. C—H...π interactions between the tapes are also observed.http://scripts.iucr.org/cgi-bin/paper?S2414314616004521crystal structurephenyltriazolethiotriazole |
| spellingShingle | Joel T. Mague Shaaban K. Mohamed Mehmet Akkurt Gamal A.-W. Ahmed Etify A. Bakhite Mustafa R. Albayati 2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide IUCrData crystal structure phenyltriazole thiotriazole |
| title | 2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide |
| title_full | 2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide |
| title_fullStr | 2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide |
| title_full_unstemmed | 2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide |
| title_short | 2-{[5-(4-Chlorophenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-nitrophenyl)acetamide |
| title_sort | 2 5 4 chlorophenoxymethyl 4 phenyl 4h 1 2 4 triazol 3 yl sulfanyl n 4 nitrophenyl acetamide |
| topic | crystal structure phenyltriazole thiotriazole |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314616004521 |
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