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Information card for entry 8101547
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| Coordinates | 8101547.cif |
|---|
| Common name | ammonium sulfanilate hydrate |
|---|---|
| Formula | C6 H12 N2 O4 S |
| Calculated formula | C6 H12 N2 O4 S |
| SMILES | S(=O)(=O)([O-])c1ccc(cc1)N.[NH4+].O |
| Title of publication | Crystal structure of ammonium sulfanilate hydrate, NH4H~2~NC~6~H4SO~3~ · H~2~O |
| Authors of publication | Schreuer, Jürgen |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 1999 |
| Journal volume | 214 |
| Journal issue | 3 |
| Pages of publication | 315 - 316 |
| a | 11.317 ± 0.002 Å |
| b | 7.562 ± 0.002 Å |
| c | 11.827 ± 0.002 Å |
| α | 90° |
| β | 109.19 ± 0.03° |
| γ | 90° |
| Cell volume | 955.9 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0314 |
| Weighted residual factors for significantly intense reflections | 0.0811 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
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