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Information card for entry 7245702
Preview
| Coordinates | 7245702.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C86 H96 N6 O34 S2 U2 |
|---|---|
| Calculated formula | C86 H96 N6 O34 S2 U2 |
| Title of publication | Varied role of organic carboxylate dizwitterions and anionic donors in mixed-ligand uranyl ion coordination polymers |
| Authors of publication | Kusumoto, Sotaro; Atoini, Youssef; Masuda, Shunya; Koide, Yoshihiro; Kim, Jee Young; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 9.2147 ± 0.0004 Å |
| b | 14.8422 ± 0.0005 Å |
| c | 17.7684 ± 0.0005 Å |
| α | 96.2142 ± 0.0011° |
| β | 90.5305 ± 0.0015° |
| γ | 91.3134 ± 0.0017° |
| Cell volume | 2415.04 ± 0.15 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0225 |
| Residual factor for significantly intense reflections | 0.0209 |
| Weighted residual factors for significantly intense reflections | 0.0521 |
| Weighted residual factors for all reflections included in the refinement | 0.0528 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278717 (current) | 2022-10-22 | cif/ Adding structures of 7245701, 7245702, 7245703, 7245704, 7245705 via cif-deposit CGI script. |
7245702.cif |
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