Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2108521
Preview
| Coordinates | 2108521.cif |
|---|---|
| Structure factors | 2108521.hkl |
| Original paper (by DOI) | HTML |
| Common name | hodgesmithite |
|---|---|
| Formula | Cu6 H16 O21 S2 Zn |
| Calculated formula | Cu6.76 H10 O21 S2 |
| Title of publication | Hodgesmithite, (Cu,Zn)~6~Zn(SO~4~)~2~(OH)~10~·3H~2~O, a new copper zinc sulfate mineral with a unique, decorated, interrupted-sheet structure |
| Authors of publication | Elliott, Peter |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 6 |
| a | 8.1905 ± 0.0012 Å |
| b | 8.1905 ± 0.0012 Å |
| c | 7.099 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 412.43 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 143 |
| Hermann-Mauguin space group symbol | P 3 |
| Hall space group symbol | P 3 |
| Residual factor for all reflections | 0.0275 |
| Residual factor for significantly intense reflections | 0.0272 |
| Weighted residual factors for significantly intense reflections | 0.0792 |
| Weighted residual factors for all reflections included in the refinement | 0.0797 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.759 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 227861 (current) | 2019-11-15 | cif/ hkl/ Adding structures of 2108521 via cif-deposit CGI script. |
2108521.cif 2108521.hkl |
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.