Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1548188
Preview
| Coordinates | 1548188.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C70 H83 P3 Y3 |
|---|---|
| Calculated formula | C70 H83 P3 Y3 |
| Title of publication | Influencing the properties of dysprosium single-molecule magnets with phosphorus donor ligands |
| Authors of publication | Thomas Pugh; Floriana Tuna; Liviu Ungur; David Collison; Eric J.L. McInnes; Liviu F. Chibotaru; Richard A. Layfield |
| Journal of publication | Nature Communications |
| Year of publication | 2015 |
| Journal volume | 6 |
| Pages of publication | 7492 |
| a | 11.6328 ± 0.0004 Å |
| b | 25.0914 ± 0.001 Å |
| c | 21.5705 ± 0.0007 Å |
| α | 90° |
| β | 91.002 ± 0.003° |
| γ | 90° |
| Cell volume | 6295.1 ± 0.4 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 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 | 0.0937 |
| Residual factor for significantly intense reflections | 0.057 |
| Weighted residual factors for significantly intense reflections | 0.1423 |
| Weighted residual factors for all reflections included in the refinement | 0.1604 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 203524 (current) | 2017-11-24 | cif/ Adding structures of 1548188 via cif-deposit CGI script. |
1548188.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.