(S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone
The crystal structure of the title compound, C12H11F3O2, was elucidated by low-temperature single-crystal X-ray diffraction. The enantiopure compound crystallizes in the Sohncke space group P21 and features one molecule in the asymmetric unit. The structure displays intermolecular O—H...O hydrogen b...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2023-01-01
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| Series: | IUCrData |
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| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314622012093 |
| _version_ | 1811168176029827072 |
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| author | Klemen Motaln Andrej Emanuel Cotman Matic Lozinšek |
| author_facet | Klemen Motaln Andrej Emanuel Cotman Matic Lozinšek |
| author_sort | Klemen Motaln |
| collection | DOAJ |
| description | The crystal structure of the title compound, C12H11F3O2, was elucidated by low-temperature single-crystal X-ray diffraction. The enantiopure compound crystallizes in the Sohncke space group P21 and features one molecule in the asymmetric unit. The structure displays intermolecular O—H...O hydrogen bonding, which links the molecules into infinite chains propagating parallel to [010]. The absolute configuration was established from anomalous dispersion. |
| first_indexed | 2024-04-10T16:21:42Z |
| format | Article |
| id | doaj.art-bbd343d51032443ebfa07f4d28d5a5dd |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-04-10T16:21:42Z |
| publishDate | 2023-01-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-bbd343d51032443ebfa07f4d28d5a5dd2023-02-09T13:29:18ZengInternational Union of CrystallographyIUCrData2414-31462023-01-0181x22120910.1107/S2414314622012093wm4178(S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetraloneKlemen Motaln0Andrej Emanuel Cotman1Matic Lozinšek2Department of Inorganic Chemistry and Technology, Jožef Stefan Institute, Jamova cesta 39, 1000 Ljubljana, SloveniaDepartment of Pharmaceutical Chemistry, Faculty of Pharmacy, University of Ljubljana, Aškerčeva cesta 7, 1000 Ljubljana, SloveniaDepartment of Inorganic Chemistry and Technology, Jožef Stefan Institute, Jamova cesta 39, 1000 Ljubljana, SloveniaThe crystal structure of the title compound, C12H11F3O2, was elucidated by low-temperature single-crystal X-ray diffraction. The enantiopure compound crystallizes in the Sohncke space group P21 and features one molecule in the asymmetric unit. The structure displays intermolecular O—H...O hydrogen bonding, which links the molecules into infinite chains propagating parallel to [010]. The absolute configuration was established from anomalous dispersion.http://scripts.iucr.org/cgi-bin/paper?S2414314622012093tetralonecrystal structureasymmetric catalysiso—h...o hydrogen bonding |
| spellingShingle | Klemen Motaln Andrej Emanuel Cotman Matic Lozinšek (S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone IUCrData tetralone crystal structure asymmetric catalysis o—h...o hydrogen bonding |
| title | (S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone |
| title_full | (S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone |
| title_fullStr | (S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone |
| title_full_unstemmed | (S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone |
| title_short | (S)-2-[(S)-2,2,2-Trifluoro-1-hydroxyethyl]-1-tetralone |
| title_sort | s 2 s 2 2 2 trifluoro 1 hydroxyethyl 1 tetralone |
| topic | tetralone crystal structure asymmetric catalysis o—h...o hydrogen bonding |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314622012093 |
| work_keys_str_mv | AT klemenmotaln s2s222trifluoro1hydroxyethyl1tetralone AT andrejemanuelcotman s2s222trifluoro1hydroxyethyl1tetralone AT maticlozinsek s2s222trifluoro1hydroxyethyl1tetralone |