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Information card for entry 1564377
Preview
| Coordinates | 1564377.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C70 H125 B N O14.5 Si3 U |
|---|---|
| Calculated formula | C70 H125 B N O14.5 Si3 U |
| Title of publication | Nitride Protonation and NH3 Binding versus N‒H Bond Cleavage in Uranium Nitrides |
| Authors of publication | Keener, Megan; Scopelliti, Rosario; Mazzanti, Marinella |
| Journal of publication | Chemical Science |
| Year of publication | 2021 |
| a | 13.6571 ± 0.0005 Å |
| b | 14.5356 ± 0.0005 Å |
| c | 22.711 ± 0.0008 Å |
| α | 78.867 ± 0.003° |
| β | 72.917 ± 0.003° |
| γ | 73.341 ± 0.003° |
| Cell volume | 4099.4 ± 0.3 Å3 |
| Cell temperature | 140 ± 0.1 K |
| Ambient diffraction temperature | 140 ± 0.1 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 | 0.0524 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.1045 |
| Weighted residual factors for all reflections included in the refinement | 0.1117 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| 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 |
|---|---|---|---|
| 268126 (current) | 2021-08-19 | cif/ Adding structures of 1564372, 1564373, 1564374, 1564375, 1564376, 1564377 via cif-deposit CGI script. |
1564377.cif |
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