Information card for entry 7125977
| Formula |
C61.5 H74 Cl4 N8 O7.5 |
| Calculated formula |
C60 H68 Cl4 N8 O6 |
| Title of publication |
Tetraphenylethene-based tetracationic dicyclophanes: synthesis, mechanochromic luminescence, and photochemical reactions. |
| Authors of publication |
Nian, Hao; Li, Aisen; Li, Yawen; Cheng, Lin; Wang, Ling; Xu, Weiqing; Cao, Liping |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2020 |
| Journal volume |
56 |
| Journal issue |
21 |
| Pages of publication |
3195 - 3198 |
| a |
11.8059 ± 0.0014 Å |
| b |
14.764 ± 0.002 Å |
| c |
19.268 ± 0.002 Å |
| α |
78.553 ± 0.005° |
| β |
73.274 ± 0.004° |
| γ |
75 ± 0.005° |
| Cell volume |
3078.7 ± 0.6 Å3 |
| Cell temperature |
114 ± 2 K |
| Ambient diffraction temperature |
114 ± 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 |
0.1066 |
| Residual factor for significantly intense reflections |
0.0725 |
| Weighted residual factors for significantly intense reflections |
0.1814 |
| Weighted residual factors for all reflections included in the refinement |
0.2024 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.053 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7125977.html
