Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4088877
Preview
| Coordinates | 4088877.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C98 H124 Cl2 N8 Y2 |
|---|---|
| Calculated formula | C98 H124 Cl2 N8 Y2 |
| Title of publication | Enantiopure Amidinate Complexes of the Rare-Earth Elements |
| Authors of publication | Brunner, Tobias S.; Benndorf, Paul; Gamer, Michael T.; Knöfel, Nicolai; Gugau, Katharina; Roesky, Peter W. |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 20 |
| Pages of publication | 3474 |
| a | 10.8692 ± 0.0002 Å |
| b | 14.5825 ± 0.0003 Å |
| c | 15.6131 ± 0.0003 Å |
| α | 93.542 ± 0.002° |
| β | 106.261 ± 0.002° |
| γ | 107.213 ± 0.002° |
| Cell volume | 2240.87 ± 0.09 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 5 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.0267 |
| Residual factor for significantly intense reflections | 0.0234 |
| Weighted residual factors for significantly intense reflections | 0.0564 |
| Weighted residual factors for all reflections included in the refinement | 0.0576 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237868 (current) | 2019-11-24 | cif/ Adding structures of 4088875, 4088876, 4088877, 4088878, 4088879, 4088880, 4088881, 4088882, 4088883, 4088884, 4088885 via cif-deposit CGI script. |
4088877.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.