Information card for entry 1573256
| Formula |
C760 H564 Cd16 N96 O16 |
| Calculated formula |
C760 H564 Cd16 N96 O16 |
| Title of publication |
Dynamic selection in metallo-organic cube Cd<sup>II</sup> <sub>8</sub>L<sub>4</sub> conformations induced by perfluorooctanoate encapsulation. |
| Authors of publication |
Li, Yu-Qing; Zhao, He; Han, Ermeng; Jiang, Zhiyuan; Bai, Qixia; Guan, Yu-Ming; Zhang, Zhe; Wu, Tun; Wang, Pingshan |
| Journal of publication |
Chemical science |
| Year of publication |
2024 |
| Journal volume |
16 |
| Journal issue |
1 |
| Pages of publication |
364 - 370 |
| a |
28.333 ± 0.003 Å |
| b |
43.635 ± 0.004 Å |
| c |
40.669 ± 0.004 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
50280 ± 9 Å3 |
| Cell temperature |
101 K |
| Ambient diffraction temperature |
101 K |
| Number of distinct elements |
5 |
| Space group number |
68 |
| Hermann-Mauguin space group symbol |
C c c a :2 |
| Hall space group symbol |
-C 2a 2ac |
| Residual factor for all reflections |
0.1581 |
| Residual factor for significantly intense reflections |
0.1346 |
| Weighted residual factors for significantly intense reflections |
0.3925 |
| Weighted residual factors for all reflections included in the refinement |
0.4217 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.826 |
| Diffraction radiation wavelength |
1.34139 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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