Information card for entry 1576578
| Formula |
C31.5 H35 Cu F6 N8 Si |
| Calculated formula |
C31.5 H35 Cu F6 N8 Si |
| Title of publication |
Crystallographic visualization of C3-hydrocarbon-induced structural transformation and guest encapsulation within a flexible coordination network |
| Authors of publication |
Qin, Shao-Jie; Shivanna, Mohana; Gao, Mei-Yan; Deng, Cheng-Hua; Wang, Shi-Qiang; Li, Dan; Fu, Shao-Dan; Qiu, Shuai; Song, Bai-Qiao; Yang, Qing-Yuan |
| Journal of publication |
Chemical Science |
| Year of publication |
2026 |
| a |
12.4446 ± 0.001 Å |
| b |
12.9292 ± 0.0011 Å |
| c |
13.327 ± 0.0011 Å |
| α |
63.239 ± 0.002° |
| β |
70.955 ± 0.002° |
| γ |
63.228 ± 0.002° |
| Cell volume |
1688.8 ± 0.2 Å3 |
| Cell temperature |
150 K |
| Ambient diffraction temperature |
150 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1294 |
| Residual factor for significantly intense reflections |
0.1166 |
| Weighted residual factors for significantly intense reflections |
0.3099 |
| Weighted residual factors for all reflections included in the refinement |
0.3215 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.075 |
| 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/1576578.html
