Information card for entry 4003845
| Formula |
C121 H112 F4 N4 O2 S4 |
| Calculated formula |
C121 H112 F4 N4 O2 S4 |
| Title of publication |
Isomeric Effect in Unidirectionally Extended Fused-Ring Electron Acceptors |
| Authors of publication |
Jia, Boyu; Li, Mengyang; Zhou, Jiadong; Xiao, Yiqun; Zhang, Shenghan; Wang, Jiayu; Lu, Xinhui; Xie, Zengqi; Tang, Zheng; Zhan, Xiaowei |
| Journal of publication |
Chemistry of Materials |
| Year of publication |
2020 |
| a |
10.7771 ± 0.0014 Å |
| b |
18.5061 ± 0.0015 Å |
| c |
26.1941 ± 0.0018 Å |
| α |
77.309 ± 0.007° |
| β |
88.059 ± 0.008° |
| γ |
90.002 ± 0.008° |
| Cell volume |
5093.5 ± 0.9 Å3 |
| Cell temperature |
149.99 ± 0.1 K |
| Ambient diffraction temperature |
149.99 ± 0.1 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 |
0.255 |
| Residual factor for significantly intense reflections |
0.1558 |
| Weighted residual factors for significantly intense reflections |
0.4464 |
| Weighted residual factors for all reflections included in the refinement |
0.526 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.221 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
1.54184 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/4003845.html
