Information card for entry 1574379
| Formula |
C6 H9.01 Cl3 N2 Zn1.01 |
| Calculated formula |
C6 H9.014 Cl3 N2.00433 Zn1.00633 |
| Title of publication |
Tuning covalent bonding in zinc-based hybrid halides towards tunable room-temperature phosphorescence |
| Authors of publication |
Cui, Yibo; Lin, Jiawei; Liu, Kunjie; Shao, Yuhe; Zhao, Dong; Guo, Zhongnan; Zhao, Jing; Xia, Zhiguo; Liu, Quanlin |
| Journal of publication |
Chemical Science |
| Year of publication |
2025 |
| Journal volume |
16 |
| Journal issue |
19 |
| Pages of publication |
8291 - 8301 |
| a |
9.909 ± 0.002 Å |
| b |
63.672 ± 0.016 Å |
| c |
6.3765 ± 0.0015 Å |
| α |
90° |
| β |
127.717 ± 0.007° |
| γ |
90° |
| Cell volume |
3182.4 ± 1.3 Å3 |
| Cell temperature |
150 ± 2 K |
| Ambient diffraction temperature |
150.15 K |
| Number of distinct elements |
5 |
| Space group number |
9 |
| Hermann-Mauguin space group symbol |
C 1 c 1 |
| Hall space group symbol |
C -2yc |
| Residual factor for all reflections |
0.1208 |
| Residual factor for significantly intense reflections |
0.0546 |
| Weighted residual factors for significantly intense reflections |
0.1048 |
| Weighted residual factors for all reflections included in the refinement |
0.1348 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.019 |
| 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/1574379.html
