Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 3000074
Preview
No preview available: structure is on hold until 2017-05-30
| Coordinates | Coordinates are not available: structure is on hold until 2017-05-30 |
|---|
| Common name | α-D-mannose |
|---|---|
| Chemical name | α-D-mannopyranose |
| Formula | C6 H12 O6 |
| Authors of publication | Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak |
| Journal of publication | To be published |
| a | 21.092 ± 0.016 Å |
| b | 8.7772 ± 0.0009 Å |
| c | 6.5461 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1211.9 ± 0.9 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Ambient diffracton pressure | 8600000 kPa |
| Number of distinct elements | 3 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0715 |
| Residual factor for significantly intense reflections | 0.0603 |
| Weighted residual factors for significantly intense reflections | 0.1521 |
| Weighted residual factors for all reflections included in the refinement | 0.163 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation wavelength | 0.4859 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | No |
| Has disorder | No |
| Has Fobs | No |
Version history
Not available for prepublication material.
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.