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Information card for entry 2312365
Preview
| Coordinates | 2312365.cif |
|---|---|
| Structure factors | 2312365.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(acetato-κ^2^<i>O</i>,<i>O</i>')(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')dioxidouranium(VI) |
|---|---|
| Formula | C14 H14 N2 O6 U |
| Calculated formula | C14 H14 N2 O6 U |
| Title of publication | Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. |
| Authors of publication | Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | 1 |
| a | 7.734 ± 0.0008 Å |
| b | 19.01 ± 0.002 Å |
| c | 10.6154 ± 0.0011 Å |
| α | 90° |
| β | 96.106 ± 0.002° |
| γ | 90° |
| Cell volume | 1551.9 ± 0.3 Å3 |
| Cell temperature | 125 ± 2 K |
| Ambient diffraction temperature | 125 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0193 |
| Residual factor for significantly intense reflections | 0.0157 |
| Weighted residual factors for significantly intense reflections | 0.0337 |
| Weighted residual factors for all reflections included in the refinement | 0.0346 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288111 (current) | 2023-12-07 | cif/ hkl/ Adding structures of 2312365, 2312366, 2312367 via cif-deposit CGI script. |
2312365.cif 2312365.hkl |
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Users of the data should acknowledge the original authors of the
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