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CIF Information Card
Information card for 1100220
1100219 << 1100220 >> 1100221Preview
|
Coordinates |
1100220.cif |
Structure parameters
| Chemical name | (4RS,5SR,1'RS)-4-(1-Chloro-1-phenylmethyl)-5-methyl-1,3-oxazolidin-2-one |
| Formula | - C11 H12 Cl N O2 - |
| Calculated formula | - C11 H12 Cl N O2 - |
| Authors of publication | T.Bach; B.Schlummer; K.Harms |
| Journal of publication | Chemistry-A European Journal |
| Year of publication | 2001 |
| Journal volume | 7 |
| Pages of publication | 2581 |
| a | 11.0478 ± 0.0012 Å |
| b | 28.024 ± 0.003 Å |
| c | 7.2693 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2250.6 Å3 |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | I b a 2 |
| Residual factor for observed reflections | 3.22 |
| Weighted residual factors for the observed reflections | 3.22 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |