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Information card for entry 7249768
Preview
| Coordinates | 7249768.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H30 N2 O20 U2 |
|---|---|
| Calculated formula | C32 H30 N2 O20 U2 |
| Title of publication | Mixed-ligand uranyl ion complexes with two flexible, pyridinium-based dicarboxylate zwitterions and simple anionic dicarboxylates |
| Authors of publication | Lee, Young Hoon; Atoini, Youssef; Kusumoto, Sotaro; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| Journal volume | 27 |
| Journal issue | 7 |
| Pages of publication | 1034 - 1043 |
| a | 8.4515 ± 0.0003 Å |
| b | 10.5811 ± 0.0004 Å |
| c | 10.585 ± 0.0003 Å |
| α | 75.8824 ± 0.0011° |
| β | 72.1083 ± 0.0012° |
| γ | 75.7896 ± 0.0014° |
| Cell volume | 858.55 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0219 |
| Residual factor for significantly intense reflections | 0.0206 |
| Weighted residual factors for significantly intense reflections | 0.051 |
| Weighted residual factors for all reflections included in the refinement | 0.0521 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.114 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298204 (current) | 2025-03-04 | cif/ Updating files of 7249764, 7249765, 7249766, 7249767, 7249768, 7249769, 7249770 Original log message: Adding full bibliography for 7249764--7249770.cif. |
7249768.cif |
| 297308 | 2025-01-14 | cif/ Adding structures of 7249764, 7249765, 7249766, 7249767, 7249768, 7249769, 7249770 via cif-deposit CGI script. |
7249768.cif |
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Users of the data should acknowledge the original authors of the
structural data.