(S)-(+)-Ketamine hydrochloride
The crystal structure of the title compound {systematic name: (S)-(+)-N-[1-(2-chlorophenyl)-2-oxocyclohexyl]methanaminium chloride}, C13H17ClNO+·Cl−, was determined at 90 (2) K. The (S)-(+)-ketamine hydrochloride salt is a well known anesthetic compound and is...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2008-08-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536808021053 |
| _version_ | 1819279430978109440 |
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| author | Patrick Hakey Wayne Ouellette Jon Zubieta Timothy Korter |
| author_facet | Patrick Hakey Wayne Ouellette Jon Zubieta Timothy Korter |
| author_sort | Patrick Hakey |
| collection | DOAJ |
| description | The crystal structure of the title compound {systematic name: (S)-(+)-N-[1-(2-chlorophenyl)-2-oxocyclohexyl]methanaminium chloride}, C13H17ClNO+·Cl−, was determined at 90 (2) K. The (S)-(+)-ketamine hydrochloride salt is a well known anesthetic compound and is dramatically more potent than its R isomer. In the title compound, the cyclohexanone ring adopts a chair conformation with the oxo group in the equatorial orientation. The methylamino and 2-chlorophenyl groups at the 2-position have an equatorial and an axial orientation, respectively. The packing of ions is stabilized by an infinite one-dimensional ...Cl...H—N—H...Cl... hydrogen-bonding network, involving NH2+ groups as donors and chloride anions as acceptors. |
| first_indexed | 2024-12-24T00:27:47Z |
| format | Article |
| id | doaj.art-e986f83ad3954a3d89190f45aa44235f |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-24T00:27:47Z |
| publishDate | 2008-08-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-e986f83ad3954a3d89190f45aa44235f2022-12-21T17:24:23ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682008-08-01648o1487o148710.1107/S1600536808021053(S)-(+)-Ketamine hydrochloridePatrick HakeyWayne OuelletteJon ZubietaTimothy KorterThe crystal structure of the title compound {systematic name: (S)-(+)-N-[1-(2-chlorophenyl)-2-oxocyclohexyl]methanaminium chloride}, C13H17ClNO+·Cl−, was determined at 90 (2) K. The (S)-(+)-ketamine hydrochloride salt is a well known anesthetic compound and is dramatically more potent than its R isomer. In the title compound, the cyclohexanone ring adopts a chair conformation with the oxo group in the equatorial orientation. The methylamino and 2-chlorophenyl groups at the 2-position have an equatorial and an axial orientation, respectively. The packing of ions is stabilized by an infinite one-dimensional ...Cl...H—N—H...Cl... hydrogen-bonding network, involving NH2+ groups as donors and chloride anions as acceptors.http://scripts.iucr.org/cgi-bin/paper?S1600536808021053 |
| spellingShingle | Patrick Hakey Wayne Ouellette Jon Zubieta Timothy Korter (S)-(+)-Ketamine hydrochloride Acta Crystallographica Section E |
| title | (S)-(+)-Ketamine hydrochloride |
| title_full | (S)-(+)-Ketamine hydrochloride |
| title_fullStr | (S)-(+)-Ketamine hydrochloride |
| title_full_unstemmed | (S)-(+)-Ketamine hydrochloride |
| title_short | (S)-(+)-Ketamine hydrochloride |
| title_sort | s ketamine hydrochloride |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536808021053 |
| work_keys_str_mv | AT patrickhakey sketaminehydrochloride AT wayneouellette sketaminehydrochloride AT jonzubieta sketaminehydrochloride AT timothykorter sketaminehydrochloride |