Information card for entry 1560841
| Formula |
C49 H34 N2 O |
| Calculated formula |
C49 H34 N2 O |
| SMILES |
O1c2c(C3(c4c1cccc4)c1c(c4c3cc(N(c3ccccc3)c3ccccc3)cc4)ccc(N(c3ccccc3)c3ccccc3)c1)cccc2 |
| Title of publication |
Organic Micro-/Nanocrystals of SFX-Based Attractor–Repulsor Molecules with the Feature of Crystal-Induced Luminescence Enhancement |
| Authors of publication |
Zhang, He; Lin, Dong-Qing; Li, Bo; Liu, Hui-Fang; Wang, Sha-Sha; Wang, Yong-Xia; Sun, Ming-Li; Lin, Zong-Qiong; Yan, Yong; Yu, Meng-Na; Xie, Ling-Hai; Huang, Wei |
| Journal of publication |
The Journal of Physical Chemistry C |
| Year of publication |
2021 |
| Journal volume |
125 |
| Journal issue |
11 |
| Pages of publication |
6249 - 6259 |
| a |
10.445 ± 0.003 Å |
| b |
11.048 ± 0.003 Å |
| c |
15.689 ± 0.005 Å |
| α |
97.771 ± 0.007° |
| β |
96.286 ± 0.008° |
| γ |
94.504 ± 0.008° |
| Cell volume |
1775 ± 0.9 Å3 |
| Cell temperature |
298.07 K |
| Ambient diffraction temperature |
298.07 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 |
0.1437 |
| Residual factor for significantly intense reflections |
0.0963 |
| Weighted residual factors for significantly intense reflections |
0.1939 |
| Weighted residual factors for all reflections included in the refinement |
0.2079 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.163 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/1560841.html
