Information card for entry 7129895
| Formula |
C37.97 H32.53 N4 O4 |
| Calculated formula |
C37.97 H32.53 N4 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 |
24.4426 ± 0.001 Å |
| b |
17.7385 ± 0.0005 Å |
| c |
7.0866 ± 0.0002 Å |
| α |
90° |
| β |
92.811 ± 0.003° |
| γ |
90° |
| Cell volume |
3068.88 ± 0.18 Å3 |
| Cell temperature |
169.99 ± 0.15 K |
| Ambient diffraction temperature |
169.99 ± 0.15 K |
| Number of distinct elements |
4 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/c 1 |
| Hall space group symbol |
-P 2ybc |
| Residual factor for all reflections |
0.0773 |
| Residual factor for significantly intense reflections |
0.0564 |
| Weighted residual factors for significantly intense reflections |
0.1529 |
| Weighted residual factors for all reflections included in the refinement |
0.1687 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.04 |
| 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/7129895.html
