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Information card for entry 1562343
Preview
Coordinates | 1562343.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C76 H170 N2 O25 Si6 U2 |
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Calculated formula | C76 H170 N2 O25 Si6 U2 |
SMILES | [U]12(=N[U](O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C)(O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C)(O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C)([O]31CCCC3)=N2)(O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C)(O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C)O[Si](OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C |
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 | 14.1108 ± 0.0003 Å |
b | 17.5538 ± 0.0003 Å |
c | 22.2467 ± 0.0004 Å |
α | 90° |
β | 91.4964 ± 0.0017° |
γ | 90° |
Cell volume | 5508.59 ± 0.18 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 | 0.0782 |
Residual factor for significantly intense reflections | 0.0697 |
Weighted residual factors for significantly intense reflections | 0.1877 |
Weighted residual factors for all reflections included in the refinement | 0.1974 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
264743 (current) | 2021-05-01 | cif/ Adding structures of 1562341, 1562342, 1562343, 1562344, 1562345 via cif-deposit CGI script. |
1562343.cif |
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Users of the data should acknowledge the original authors of the
structural data.