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Information card for entry 1573684
Preview
| Coordinates | 1573684.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Acetyl α-<i>D</i>-2,3,4-triacetyllyxopyranoside |
|---|---|
| Formula | C13 H18 O9 |
| Calculated formula | C13 H18 O9 |
| Authors of publication | Culver, Shawn; Rhoad, Jonathan S. |
| Year of publication | 2025 |
| a | 8.1174 ± 0.0003 Å |
| b | 9.5597 ± 0.0004 Å |
| c | 10.258 ± 0.0004 Å |
| α | 90° |
| β | 109.734 ± 0.0014° |
| γ | 90° |
| Cell volume | 749.27 ± 0.05 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.032 |
| Residual factor for significantly intense reflections | 0.0317 |
| Weighted residual factors for significantly intense reflections | 0.0755 |
| Weighted residual factors for all reflections included in the refinement | 0.0757 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297287 (current) | 2025-01-11 | cif/ Adding structures of 1573684 via cif-deposit CGI script. |
1573684.cif |
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