Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1558284
Preview
| Coordinates | 1558284.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C99 H144 K4 Si8 Th2 |
|---|---|
| Calculated formula | C99 H144 K4 Si8 Th2 |
| Title of publication | Heteroleptic Actinocenes: A Thorium(IV)-Cyclobutadienyl-Cyclooctatetraenyl-Di-Potassium-Cyclooctatetraenyl Complex |
| Authors of publication | Boronski, Josef; Wooles, Ashley; Liddle, Stephen |
| Journal of publication | Chemical Science |
| Year of publication | 2020 |
| a | 24.4252 ± 0.0001 Å |
| b | 10.9277 ± 0.0001 Å |
| c | 40.2845 ± 0.0002 Å |
| α | 90° |
| β | 107.399 ± 0.001° |
| γ | 90° |
| Cell volume | 10260.4 ± 0.13 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0259 |
| Residual factor for significantly intense reflections | 0.0251 |
| Weighted residual factors for significantly intense reflections | 0.0633 |
| Weighted residual factors for all reflections included in the refinement | 0.0637 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 253076 (current) | 2020-06-11 | cif/ Adding structures of 1558284 via cif-deposit CGI script. |
1558284.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.