Information card for entry 7129894
| Formula |
C36 H34 N2 O4 |
| Calculated formula |
C36 H34 N2 O4 |
| Title of publication |
Perylene Five-membered Ring Diimide for Organic Semiconductors and π-Expanded Conjugated Molecules |
| Authors of publication |
Chen, Liangliang; Wu, Botao; Qin, Liyuan; Huang, Yan-Ying; Meng, Wei; Kong, Ruirui; Yu, Xiaobo; ChenChai, Kaiyuan; Li, Cheng; Zhang, Guanxin; Zhang, Xisha; Zhang, Deqing |
| Journal of publication |
Chemical Communications |
| Year of publication |
2022 |
| a |
10.8776 ± 0.0007 Å |
| b |
14.0655 ± 0.0013 Å |
| c |
18.9337 ± 0.0013 Å |
| α |
95.71 ± 0.007° |
| β |
103.58 ± 0.006° |
| γ |
93.738 ± 0.006° |
| Cell volume |
2790.1 ± 0.4 Å3 |
| Cell temperature |
169.99 ± 0.14 K |
| Ambient diffraction temperature |
169.99 ± 0.14 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1966 |
| Residual factor for significantly intense reflections |
0.1411 |
| Weighted residual factors for significantly intense reflections |
0.3237 |
| Weighted residual factors for all reflections included in the refinement |
0.3799 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.167 |
| 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/7129894.html
