Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7130834
Preview
| Coordinates | 7130834.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C84 H342 Co12 Mo80 N24 O489 P36 Pb4 |
|---|---|
| Calculated formula | C84 H84 Co12 Mo80 N24 O360 P36 Pb4 |
| Title of publication | Self-assembly of a novel multicomponent polyoxometalate-based tetrahedral supercluster with high catalytic activity for thioether oxidation |
| Authors of publication | Liu, Xiaodong; Xu, Na; Liu, Xiaohui; Guo, Yanyan; Wang, Xiuli |
| Journal of publication | Chemical Communications |
| Year of publication | 2022 |
| a | 30.9076 ± 0.0013 Å |
| b | 57.925 ± 0.002 Å |
| c | 32.2149 ± 0.0016 Å |
| α | 90° |
| β | 109.355 ± 0.002° |
| γ | 90° |
| Cell volume | 54415 ± 4 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 8 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0616 |
| Residual factor for significantly intense reflections | 0.0429 |
| Weighted residual factors for significantly intense reflections | 0.1036 |
| Weighted residual factors for all reflections included in the refinement | 0.1138 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Diffraction radiation X-ray symbol | K-L~3~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278510 (current) | 2022-10-11 | cif/ Adding structures of 7130834 via cif-deposit CGI script. |
7130834.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.