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Information card for entry 2004900
Preview
| Coordinates | 2004900.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C7 H12 O5 |
|---|---|
| Calculated formula | C7 H12 O5 |
| Title of publication | Synthesis and Relative Configuration of (±)-(1α,2β,3β,4α)-1,2,3,4-Cyclopentanetetrol 1-Acetate |
| Authors of publication | Zukerman-Schpector, J.; Caracelli, I.; Varanda, N. A.; Brockson, U. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1996 |
| Journal volume | 52 |
| Journal issue | 5 |
| Pages of publication | 1298 - 1299 |
| a | 6.374 ± 0.001 Å |
| b | 9.917 ± 0.002 Å |
| c | 26.743 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1690.5 ± 0.5 Å3 |
| Cell temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0711 |
| Residual factor for significantly intense reflections | 0.0472 |
| Weighted residual factors for all reflections | 0.3476 |
| Weighted residual factors for significantly intense reflections | 0.1185 |
| Goodness-of-fit parameter for all reflections | 1.082 |
| Goodness-of-fit parameter for significantly intense reflections | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.