Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4070560
Preview
| Coordinates | 4070560.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C51 H67 K N3 O8 S6 U |
|---|---|
| Calculated formula | C51 H67 K N3 O8 S6 U |
| Title of publication | Uranium and Lanthanide Complexes with the 2-Mercapto Benzothiazolate Ligand: Evidence for a Specific Covalent Binding Site in the Differentiation of Isostructural Lanthanide(III) and Actinide(III) Compounds |
| Authors of publication | Roger, Mathieu; Belkhiri, Lotfi; Arliguie, Thérèse; Thuéry, Pierre; Boucekkine, Abdou; Ephritikhine, Michel |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 1 |
| Pages of publication | 33 |
| a | 11.5158 ± 0.0005 Å |
| b | 12.3498 ± 0.0007 Å |
| c | 21.6525 ± 0.0012 Å |
| α | 90.184 ± 0.003° |
| β | 93.485 ± 0.003° |
| γ | 114.484 ± 0.003° |
| Cell volume | 2795.9 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0576 |
| Residual factor for significantly intense reflections | 0.0445 |
| Weighted residual factors for significantly intense reflections | 0.0978 |
| Weighted residual factors for all reflections included in the refinement | 0.104 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178594 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/05. |
4070560.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070560.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070560.cif |
| 42559 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070558, 4070559, 4070560, 4070561, 4070562, 4070563 via cif-deposit CGI script. |
4070560.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.