Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1563926
Preview
| Coordinates | 1563926.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H79.5 N5.5 O3 Tb |
|---|---|
| Calculated formula | C54 H79.5 N5.5 O3 Tb |
| Title of publication | Structural and spectroscopic investigations of redox active seven coordinate luminescent lanthanide complexes |
| Authors of publication | Molloy, Jennifer K.; Fedele, Lionel; Jarjayes, Olivier; Philouze, Christian; Imbert, Daniel; Thomas, Fabrice |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2018 |
| Journal volume | 483 |
| Pages of publication | 609 - 617 |
| a | 27.646 ± 0.003 Å |
| b | 27.646 ± 0.003 Å |
| c | 27.646 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 21130 ± 4 Å3 |
| Cell temperature | 200 K |
| Ambient diffraction temperature | 200 K |
| Number of distinct elements | 5 |
| Space group number | 206 |
| Hermann-Mauguin space group symbol | I a -3 |
| Hall space group symbol | -I 2b 2c 3 |
| Residual factor for all reflections | 0.0775 |
| Residual factor for significantly intense reflections | 0.0345 |
| Weighted residual factors for significantly intense reflections | 0.0695 |
| Weighted residual factors for all reflections included in the refinement | 0.1057 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.394 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266989 (current) | 2021-07-05 | cif/ Adding structures of 1563925, 1563926, 1563927, 1563928 via cif-deposit CGI script. |
1563926.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.