Information card for entry 1562690
| Formula |
C233 H147 Br12 N24 O49 |
| Calculated formula |
C233 H147 Br12 N24 O49 |
| Title of publication |
A water-soluble naphthalenediimide-containing hexacationic cage. |
| Authors of publication |
Fang, Shuai; Li, Errui; Zhu, Dingsheng; Wu, Guangcheng; Zhang, Qinhao; Lin, Chuhao; Huang, Feihe; Li, Hao |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2021 |
| Journal volume |
57 |
| Journal issue |
49 |
| Pages of publication |
6074 - 6077 |
| a |
21.62 ± 0.003 Å |
| b |
25.189 ± 0.003 Å |
| c |
26.682 ± 0.003 Å |
| α |
99.495 ± 0.009° |
| β |
108.239 ± 0.007° |
| γ |
105.86 ± 0.007° |
| Cell volume |
12767 ± 3 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 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 |
0.1836 |
| Residual factor for significantly intense reflections |
0.1431 |
| Weighted residual factors for significantly intense reflections |
0.3051 |
| Weighted residual factors for all reflections included in the refinement |
0.3198 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.007 |
| Diffraction radiation wavelength |
1.34139 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/1562690.html
