Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4004047
Preview
| Coordinates | 4004047.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41 H18 Co2 N2 O11 |
|---|---|
| Calculated formula | C40.5 H22 Co2 N2 O11 |
| Title of publication | Integration of Fluorescent Functionality into Pressure-Amplifying Metal–Organic Frameworks |
| Authors of publication | Walenszus, Francesco; Evans, Jack D.; Bon, Volodymyr; Schwotzer, Friedrich; Senkovska, Irena; Kaskel, Stefan |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2021 |
| Journal volume | 33 |
| Journal issue | 20 |
| Pages of publication | 7964 - 7971 |
| a | 46.52 ± 0.005 Å |
| b | 46.52 ± 0.005 Å |
| c | 46.52 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 100674 ± 19 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 225 |
| Hermann-Mauguin space group symbol | F m -3 m |
| Hall space group symbol | -F 4 2 3 |
| Residual factor for all reflections | 0.1778 |
| Residual factor for significantly intense reflections | 0.1445 |
| Weighted residual factors for significantly intense reflections | 0.3768 |
| Weighted residual factors for all reflections included in the refinement | 0.4208 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.945 |
| Diffraction radiation wavelength | 0.895 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270264 (current) | 2021-11-04 | cif/ Adding structures of 4004045, 4004046, 4004047 via cif-deposit CGI script. |
4004047.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.