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Information card for entry 2019269
Preview
| Coordinates | 2019269.cif |
|---|---|
| Original IUCr paper | HTML |
| External links | PubChem |
| Common name | Gaboxadol hydrochloride |
|---|---|
| Chemical name | 4,5,6,7-Tetrahydroisoxazolo[5,4-c]pyridin-3-ol hydrochloride |
| Formula | C6 H9 Cl N2 O2 |
| Calculated formula | C6 H9 Cl N2 O2 |
| Title of publication | Enantiotropically related polymorphs of gaboxadol hydrochloride |
| Authors of publication | Lopez de Diego, Heidi; Koradia, Vishal; Bond, Andrew D. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 11 |
| Pages of publication | 1234 - 1237 |
| a | 13.6018 Å |
| b | 6.6783 Å |
| c | 17.0168 Å |
| α | 89.683° |
| β | 92.077° |
| γ | 99.652° |
| Cell volume | 1522.87 Å3 |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | I -1 |
| Hall space group symbol | -P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z) |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301798 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/01 Each referenced PubChem compound corresponds to the full crystal structure. |
2019269.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
2019269.cif |
| 91269 | 2013-12-10 | cif/2/01/ (saulius@koala.ibt.lt) Adding '92/2019269.cif' despite having no thermal ADP parameters, since it was indeed published in http://dx.doi.org/10.1107/S0108270113025961 (as were also 2019267.cif and 2019268.cif). |
2019269.cif |
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Users of the data should acknowledge the original authors of the
structural data.