Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7229268
Preview
| Coordinates | 7229268.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Ca2.87 Cd9.13 O36 Se12 |
|---|---|
| Calculated formula | Ca2.864 Cd9.136 O36 Se12 |
| Title of publication | Alkali Earth MOx (x=6, 7, 9, 12) Polyhedra Tuned Cadmium Selenites with Different Dimensions and Diverse SeO32-Coordinations |
| Authors of publication | Jia, Ying-Jie; Chen, Yi-Gang; Yao, Xiao-Ni; Zhang, Xian-Ming |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| a | 8.4611 ± 0.0005 Å |
| b | 12.1273 ± 0.0007 Å |
| c | 9.4968 ± 0.0005 Å |
| α | 90° |
| β | 108.251 ± 0.001° |
| γ | 90° |
| Cell volume | 925.45 ± 0.09 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0174 |
| Residual factor for significantly intense reflections | 0.0172 |
| Weighted residual factors for significantly intense reflections | 0.04 |
| Weighted residual factors for all reflections included in the refinement | 0.0401 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201573 (current) | 2017-10-03 | cif/ Adding structures of 7229265, 7229266, 7229267, 7229268 via cif-deposit CGI script. |
7229268.cif |
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.