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Information card for entry 7247372
Preview
| Coordinates | 7247372.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H24 N2 O16 U2 |
|---|---|
| Calculated formula | C36 H24 N2 O16 U2 |
| Title of publication | Ligand competition on uranyl ion: further examples of zwitterionic vs. anionic carboxylate coordination |
| Authors of publication | Kusumoto, Sotaro; Atoini, Youssef; Koide, Yoshihiro; Hayami, Shinya; Kim, Yang; Harrowfield, Jack; Thuéry, Pierre |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 40 |
| Pages of publication | 5748 - 5758 |
| a | 9.7035 ± 0.0006 Å |
| b | 9.714 ± 0.0006 Å |
| c | 10.6933 ± 0.0007 Å |
| α | 79.359 ± 0.004° |
| β | 75.201 ± 0.003° |
| γ | 71.662 ± 0.003° |
| Cell volume | 919.03 ± 0.1 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 | 0.0318 |
| Residual factor for significantly intense reflections | 0.0298 |
| Weighted residual factors for significantly intense reflections | 0.0753 |
| Weighted residual factors for all reflections included in the refinement | 0.0769 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287346 (current) | 2023-11-06 | cif/ Updating files of 7247370, 7247371, 7247372, 7247373 Original log message: Adding full bibliography for 7247370--7247373.cif. |
7247372.cif |
| 286306 | 2023-09-13 | cif/ Adding structures of 7247370, 7247371, 7247372, 7247373 via cif-deposit CGI script. |
7247372.cif |
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Users of the data should acknowledge the original authors of the
structural data.