Information card for entry 4003853
| Formula |
C45 H59 N6 O6 S6 |
| Calculated formula |
C45 H59 N6 O6 S6 |
| Title of publication |
High-Performance Organic Semiconducting Polymers by a Resonance-Assisted Hydrogen Bonding Approach |
| Authors of publication |
Liu, Bingyong; Li, Jing; Zeng, Wenwu; Yang, Wei; Yan, Hui; Li, Da-cheng; Zhou, Yinhua; Gao, Xike; Zhang, Qing |
| Journal of publication |
Chemistry of Materials |
| Year of publication |
2021 |
| Journal volume |
33 |
| Journal issue |
2 |
| Pages of publication |
580 - 588 |
| a |
4.851 ± 0.003 Å |
| b |
15.583 ± 0.013 Å |
| c |
31.935 ± 0.019 Å |
| α |
84.3 ± 0.07° |
| β |
89.69 ± 0.06° |
| γ |
88.27 ± 0.05° |
| Cell volume |
2401 ± 3 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 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 |
0.1999 |
| Residual factor for significantly intense reflections |
0.1026 |
| Weighted residual factors for significantly intense reflections |
0.313 |
| Weighted residual factors for all reflections included in the refinement |
0.3801 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.964 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/4003853.html
