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Information card for entry 2312366
Preview
| Coordinates | 2312366.cif |
|---|---|
| Structure factors | 2312366.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[bis(2,3'-bipyridinium) [di-μ-acetato-μ~3~-hydroxido-μ-hydroxido-di-μ~3~-oxido-hexaoxidotriuranium(VI)]–2,3'-bipyridine–water (1/1/1)] |
|---|---|
| Formula | C34 H36 N6 O15 U3 |
| Calculated formula | C34 H36 N6 O15 U3 |
| 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 | 13.809 ± 0.0013 Å |
| b | 12.6324 ± 0.0012 Å |
| c | 23.699 ± 0.002 Å |
| α | 90° |
| β | 103.412 ± 0.001° |
| γ | 90° |
| Cell volume | 4021.3 ± 0.6 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 | 0.0659 |
| Residual factor for significantly intense reflections | 0.0347 |
| Weighted residual factors for significantly intense reflections | 0.0592 |
| Weighted residual factors for all reflections included in the refinement | 0.0679 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
| 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. |
2312366.cif 2312366.hkl |
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Users of the data should acknowledge the original authors of the
structural data.