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Information card for entry 1567207
Preview
| Coordinates | 1567207.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C66 H162 K6 N6 O16 Si10 U2 |
|---|---|
| Calculated formula | C66 H162 K6 N6 O16 Si10 U2 |
| SMILES | [U]12(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)(=[N]=[U]3(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)(N1)#N)N([Si](C)(C)C)[Si]([CH2]23)(C)C.[K+].[K+].[K+].[K+].[K+].[K+].[Si]([N-][Si](C)(C)C)(C)(C)C.[Si]([N-][Si](C)(C)C)(C)(C)C |
| Title of publication | Nitrogen activation and cleavage by a multimetallic uranium complex. |
| Authors of publication | Keener, Megan; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Zivkovic, Ivica; Mazzanti, Marinella |
| Journal of publication | Chemical science |
| Year of publication | 2022 |
| Journal volume | 13 |
| Journal issue | 27 |
| Pages of publication | 8025 - 8035 |
| a | 15.102 ± 0.0006 Å |
| b | 29.934 ± 0.0016 Å |
| c | 27.0037 ± 0.0008 Å |
| α | 90° |
| β | 99.035 ± 0.004° |
| γ | 90° |
| Cell volume | 12055.9 ± 0.9 Å3 |
| Cell temperature | 139.99 ± 0.1 K |
| Ambient diffraction temperature | 139.99 ± 0.1 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1567 |
| Residual factor for significantly intense reflections | 0.0863 |
| Weighted residual factors for significantly intense reflections | 0.2043 |
| Weighted residual factors for all reflections included in the refinement | 0.2436 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277096 (current) | 2022-08-06 | cif/ Updating files of 1567201, 1567202, 1567203, 1567204, 1567205, 1567206, 1567207, 1567208, 1567209, 1567210, 1567211, 1567212 Original log message: Adding full bibliography for 1567201--1567212.cif. |
1567207.cif |
| 276455 | 2022-07-01 | cif/ Adding structures of 1567201, 1567202, 1567203, 1567204, 1567205, 1567206, 1567207, 1567208, 1567209, 1567210, 1567211, 1567212 via cif-deposit CGI script. |
1567207.cif |
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Users of the data should acknowledge the original authors of the
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