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Information card for entry 1548093
Preview
| Coordinates | 1548093.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C52.5 H116.5 N5 O6 Rb Si3 U |
|---|---|
| Calculated formula | C45 H99 N5 O6 Rb Si3 U |
| Title of publication | Molecular and electronic structure of terminal and alkali metal-capped uranium(V) nitride complexes |
| Authors of publication | David M. King; Peter A. Cleaves; Ashley J. Wooles; Benedict M. Gardner; Nicholas F. Chilton; Floriana Tuna; William Lewis; Eric J. L. McInnes; Stephen T. Liddle |
| Journal of publication | Nature Communications |
| Year of publication | 2016 |
| Journal volume | 7 |
| Pages of publication | 13773 |
| a | 23.7586 ± 0.0003 Å |
| b | 23.7586 ± 0.0003 Å |
| c | 23.7586 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 13411 ± 0.3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 205 |
| Hermann-Mauguin space group symbol | P a -3 |
| Hall space group symbol | -P 2ac 2ab 3 |
| Residual factor for all reflections | 0.0816 |
| Residual factor for significantly intense reflections | 0.0699 |
| Weighted residual factors for significantly intense reflections | 0.1987 |
| Weighted residual factors for all reflections included in the refinement | 0.212 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 203277 (current) | 2017-11-17 | cif/ Adding structures of 1548093 via cif-deposit CGI script. |
1548093.cif |
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Users of the data should acknowledge the original authors of the
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