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CIF Information Card
Information card for 7150001
7150000 << 7150001 >> 7150002Preview
|
Coordinates |
7150001.cif |
Structure parameters
| Formula | - C4 H5 N O4 - |
| Calculated formula | - C4 H5 N O4 - |
| Title of publication | Studies related to carba-pyranoses: synthesis of acetylated derivatives of 4-amino-2,4-dideoxy-3-O-(beta-D-glucopyranosyl)-beta-L-(and beta-D-) altrocarba-pyranose from a D-glucose template. |
| Authors of publication | Pritchard, Robin G.; Stoodley, Richard J.; Yuen, Wai-Hung |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2005 |
| Journal volume | 3 |
| Journal issue | 1 |
| Pages of publication | 162 - 171 |
| a | 5.356 ± 0.002 Å |
| b | 6.688 ± 0.002 Å |
| c | 16.787 ± 0.007 Å |
| α | 90° |
| β | 96.99 ± 0.03° |
| γ | 90° |
| Cell volume | 596.9 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.0829 |
| Residual factor for observed reflections | 0.0534 |
| Weighted residual factors for the observed reflections | 0.1216 |
| Weighted residual factors for all reflections included in the refinement | 0.1404 |
| Goodness-of-fit parameter for observed reflections | 1.146 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |