Information card for entry 7134991
| Formula |
C58 H34 N4 O2 |
| Calculated formula |
C58 H34 N4 O2 |
| Title of publication |
Charge-transfer modulated chiroptical azacyclooctatetraene-fused [5]helicenes with AIE features. |
| Authors of publication |
Yin, Xiaojun; Chen, Xuefeng; Mo, Xuechao; Chen, Junjin; Huang, Mengyu; Ma, Jiacheng; Li, Yulan; Li, Nengquan; Yang, Chuluo |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2025 |
| Journal volume |
61 |
| Journal issue |
84 |
| Pages of publication |
16448 - 16451 |
| a |
8.8479 ± 0.0004 Å |
| b |
11.4027 ± 0.0005 Å |
| c |
11.4991 ± 0.0005 Å |
| α |
86.241 ± 0.002° |
| β |
72.076 ± 0.002° |
| γ |
68.194 ± 0.002° |
| Cell volume |
1023.29 ± 0.08 Å3 |
| Cell temperature |
170 K |
| Ambient diffraction temperature |
170 K |
| Number of distinct elements |
4 |
| Space group number |
1 |
| Hermann-Mauguin space group symbol |
P 1 |
| Hall space group symbol |
P 1 |
| Residual factor for all reflections |
0.0443 |
| Residual factor for significantly intense reflections |
0.0423 |
| Weighted residual factors for significantly intense reflections |
0.109 |
| Weighted residual factors for all reflections included in the refinement |
0.1104 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.067 |
| Diffraction radiation wavelength |
1.34139 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7134991.html
