Information card for entry 7251705
| Formula |
C131 H180 F6 I N18 O18 S2 |
| Calculated formula |
C131 H180 F6 I N18 O18 S2 |
| Title of publication |
Guest-Induced Diverse Self-Assembles of an Oligopyrrole |
| Authors of publication |
Fang, Yicheng; Wei, Huiqi; Li, Caixia; Liu, Gen; Wang, Fan; Wu, Lamei; Huang, Zhengxi; Chen, Xi; Zhang, Zhan |
| Journal of publication |
CrystEngComm |
| Year of publication |
2026 |
| a |
18.9098 ± 0.0011 Å |
| b |
20.9683 ± 0.0011 Å |
| c |
23.7373 ± 0.0015 Å |
| α |
96.441 ± 0.002° |
| β |
97.288 ± 0.003° |
| γ |
112.541 ± 0.002° |
| Cell volume |
8488.9 ± 0.9 Å3 |
| Cell temperature |
100 ± 2 K |
| Ambient diffraction temperature |
100 ± 2 K |
| Number of distinct elements |
7 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0995 |
| Residual factor for significantly intense reflections |
0.0773 |
| Weighted residual factors for significantly intense reflections |
0.2087 |
| Weighted residual factors for all reflections included in the refinement |
0.2246 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.042 |
| Diffraction radiation wavelength |
1.34139 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7251705.html
