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CIF Information Card
Information card for 2200223
2200222 << 2200223 >> 2200224Preview
|
Coordinates |
2200223.cif |
Structure parameters
| Formula | - C11 H13 N O2 S2 - |
| Calculated formula | - C11 H13 N O2 S2 - |
| Title of publication | (E)-3-Methoxy-3-methylsulfanylisothiochroman-4-one oxime |
| Authors of publication | Coustard, Jean-Marie; Le Toquin, Ronan; Leo, Roland; Paulus, Werner; Cousson, Alain |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Pages of publication | o256 - o257 |
| a | 9.3725 ± 0.0002 Å |
| b | 10.7012 ± 0.0002 Å |
| c | 23.0919 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2316 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P b c a |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |