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Information card for entry 1562342
Preview
| Coordinates | 1562342.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C80 H184 N2 O26 Si6 U2 |
|---|---|
| Calculated formula | C80 H184 N2 O26 Si6 U2 |
| Title of publication | Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides |
| Authors of publication | Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 14.34057 ± 0.00014 Å |
| b | 17.69858 ± 0.00018 Å |
| c | 22.05 ± 0.00018 Å |
| α | 90° |
| β | 91.5214 ± 0.0008° |
| γ | 90° |
| Cell volume | 5594.49 ± 0.09 Å3 |
| Cell temperature | 140 ± 0.1 K |
| Ambient diffraction temperature | 140 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0393 |
| Residual factor for significantly intense reflections | 0.0382 |
| Weighted residual factors for significantly intense reflections | 0.094 |
| Weighted residual factors for all reflections included in the refinement | 0.0949 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301787 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 1/56 Each referenced PubChem compound corresponds to the full crystal structure. |
1562342.cif |
| 264743 | 2021-05-01 | cif/ Adding structures of 1562341, 1562342, 1562343, 1562344, 1562345 via cif-deposit CGI script. |
1562342.cif |
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Users of the data should acknowledge the original authors of the
structural data.