Information card for entry 7245702
| 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 |
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https://www.crystallography.net/7245702.html
