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Information card for entry 2006313
Preview
| Coordinates | 2006313.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Methyl 2-aza-2-deoxy-4,6-di-O-methyl-2-N-(p-nitrophenylamino)-β-D-erythro- hexopyranosid-3-ulose. |
|---|---|
| Formula | C14 H19 N3 O7 |
| Calculated formula | C14 H19 N3 O7 |
| Title of publication | Methyl 2-Aza-2-deoxy-4,6-di-<i>O</i>-methyl-2-<i>N</i>-(<i>p</i>-nitrophenylamino)-β-<small>D</small>-<i>erythro</i>-hexopyranosid-3-ulose |
| Authors of publication | Bernardinelli, Gérald; Tronchet, Jeannine F.; Tronchet, Jean M.J. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1997 |
| Journal volume | 53 |
| Journal issue | 7 |
| Pages of publication | 950 - 951 |
| a | 21.574 ± 0.001 Å |
| b | 4.5576 ± 0.0009 Å |
| c | 17.039 ± 0.002 Å |
| α | 90° |
| β | 104.238 ± 0.005° |
| γ | 90° |
| Cell volume | 1623.9 ± 0.4 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.12 |
| Residual factor for significantly intense reflections | 0.076 |
| Weighted residual factors for all reflections | 0.083 |
| Weighted residual factors for significantly intense reflections | 0.074 |
| Goodness-of-fit parameter for all reflections | 2.172 |
| Goodness-of-fit parameter for significantly intense reflections | 2.342 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| 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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