Information card for entry 1566925
| Formula |
C114 H108 O12 |
| Calculated formula |
C114 H108 O12 |
| Title of publication |
Cagearenes: synthesis, characterization, and application for programmed vapor release |
| Authors of publication |
Fang, Shuai; Wang, Mengbin; Wu, Yating; Guo, Qing-Hui; Li, Errui; Li, Hao; Huang, Feihe |
| Journal of publication |
Chemical Science |
| Year of publication |
2022 |
| a |
13.898 ± 0.004 Å |
| b |
19.031 ± 0.006 Å |
| c |
24.191 ± 0.008 Å |
| α |
112.073 ± 0.013° |
| β |
103.948 ± 0.014° |
| γ |
93.107 ± 0.01° |
| Cell volume |
5680 ± 3 Å3 |
| Cell temperature |
170 ± 2 K |
| Ambient diffraction temperature |
170 K |
| Number of distinct elements |
3 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0799 |
| Residual factor for significantly intense reflections |
0.055 |
| Weighted residual factors for significantly intense reflections |
0.143 |
| Weighted residual factors for all reflections included in the refinement |
0.162 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.979 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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