Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 3000568
Preview
No preview available: structure is on hold until 2025-04-18
| Coordinates | Coordinates are not available: structure is on hold until 2025-04-18 |
|---|
| Common name | hexakis(urea-O)iron(III) nitrate |
|---|---|
| Chemical name | hexakis(urea-O)iron(III) nitrate |
| Formula | C3 H12 Fe0.5 N7.458 O7.373 |
| Authors of publication | Toms Rekis |
| Journal of publication | To be published |
| a | 11.1534 ± 0.0004 Å |
| b | 18.6443 ± 0.0006 Å |
| c | 12.1716 ± 0.0005 Å |
| α | 90° |
| β | 112.38 ± 0.004° |
| γ | 90° |
| Cell volume | 2340.41 ± 0.16 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1514 |
| Residual factor for significantly intense reflections | 0.0887 |
| Weighted residual factors for significantly intense reflections | 0.1067 |
| Weighted residual factors for all reflections included in the refinement | 0.1103 |
| Goodness-of-fit parameter for significantly intense reflections | 4.41 |
| Goodness-of-fit parameter for all reflections included in the refinement | 3.08 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.5 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.