Crystal structure of cyproconazole
The title compound [systematic name: 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol], C15H18ClN3O, is a conazole fungicide. The asymmetric unit comprises two enantiomeric pairs (molecules A and B) in which the dihedral angles between the chlorophenyl and triazole rings are 46.5...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2015-12-01
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| Series: | Acta Crystallographica Section E: Crystallographic Communications |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2056989015022665 |
| _version_ | 1818997648471883776 |
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| author | Gihaeng Kang Jineun Kim Eunjin Kwon Tae Ho Kim |
| author_facet | Gihaeng Kang Jineun Kim Eunjin Kwon Tae Ho Kim |
| author_sort | Gihaeng Kang |
| collection | DOAJ |
| description | The title compound [systematic name: 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol], C15H18ClN3O, is a conazole fungicide. The asymmetric unit comprises two enantiomeric pairs (molecules A and B) in which the dihedral angles between the chlorophenyl and triazole rings are 46.54 (9) (molecule A) and 67.03 (8)° (molecule B). In the crystal, C—H...O, O—H...N and C—H...Cl hydrogen bonds and weak C—H...π interactions [3.473 (2) Å] link adjacent molecules, forming columns along the a axis. |
| first_indexed | 2024-12-20T21:48:58Z |
| format | Article |
| id | doaj.art-6a2ecc42567c48e7a4ef6bcdbc77cbb3 |
| institution | Directory Open Access Journal |
| issn | 2056-9890 |
| language | English |
| last_indexed | 2024-12-20T21:48:58Z |
| publishDate | 2015-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E: Crystallographic Communications |
| spelling | doaj.art-6a2ecc42567c48e7a4ef6bcdbc77cbb32022-12-21T19:25:37ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902015-12-017112o1007o100710.1107/S2056989015022665hg5465Crystal structure of cyproconazoleGihaeng Kang0Jineun Kim1Eunjin Kwon2Tae Ho Kim3Department of Chemistry and Research Institute of Natural Sciences, Gyeongsang National University, Jinju 52828, Republic of KoreaDepartment of Chemistry and Research Institute of Natural Sciences, Gyeongsang National University, Jinju 52828, Republic of KoreaDepartment of Chemistry and Research Institute of Natural Sciences, Gyeongsang National University, Jinju 52828, Republic of KoreaDepartment of Chemistry and Research Institute of Natural Sciences, Gyeongsang National University, Jinju 52828, Republic of KoreaThe title compound [systematic name: 2-(4-chlorophenyl)-3-cyclopropyl-1-(1H-1,2,4-triazol-1-yl)butan-2-ol], C15H18ClN3O, is a conazole fungicide. The asymmetric unit comprises two enantiomeric pairs (molecules A and B) in which the dihedral angles between the chlorophenyl and triazole rings are 46.54 (9) (molecule A) and 67.03 (8)° (molecule B). In the crystal, C—H...O, O—H...N and C—H...Cl hydrogen bonds and weak C—H...π interactions [3.473 (2) Å] link adjacent molecules, forming columns along the a axis.http://scripts.iucr.org/cgi-bin/paper?S2056989015022665crystal structurecyproconazolebutan-2-olfungicidal propertieshydrogen bonding |
| spellingShingle | Gihaeng Kang Jineun Kim Eunjin Kwon Tae Ho Kim Crystal structure of cyproconazole Acta Crystallographica Section E: Crystallographic Communications crystal structure cyproconazole butan-2-ol fungicidal properties hydrogen bonding |
| title | Crystal structure of cyproconazole |
| title_full | Crystal structure of cyproconazole |
| title_fullStr | Crystal structure of cyproconazole |
| title_full_unstemmed | Crystal structure of cyproconazole |
| title_short | Crystal structure of cyproconazole |
| title_sort | crystal structure of cyproconazole |
| topic | crystal structure cyproconazole butan-2-ol fungicidal properties hydrogen bonding |
| url | http://scripts.iucr.org/cgi-bin/paper?S2056989015022665 |
| work_keys_str_mv | AT gihaengkang crystalstructureofcyproconazole AT jineunkim crystalstructureofcyproconazole AT eunjinkwon crystalstructureofcyproconazole AT taehokim crystalstructureofcyproconazole |