Information card for entry 7134615
| Formula |
C10 H18 Br N |
| Calculated formula |
C10 H18 Br N |
| Title of publication |
Unlocking ferroelectricity in a metal-free adamantane derivative via targeted symmetry reduction |
| Authors of publication |
Xu, Wei-Jian; Alikin, Denis; Fang, Zi-Luo; Romanyuk, Konstantin; Verissimo, Luis; Zelenovskii, Pavel; Zhang, Wei-Xiong; Kholkin, Andrei; Rocha, João |
| Journal of publication |
Chemical Communications |
| Year of publication |
2025 |
| Journal volume |
61 |
| Journal issue |
51 |
| Pages of publication |
9286 - 9289 |
| a |
7.7656 ± 0.0003 Å |
| b |
6.4026 ± 0.0002 Å |
| c |
10.1581 ± 0.0004 Å |
| α |
90° |
| β |
102.526 ± 0.004° |
| γ |
90° |
| Cell volume |
493.04 ± 0.03 Å3 |
| Cell temperature |
298.15 K |
| Ambient diffraction temperature |
298.15 K |
| Number of distinct elements |
4 |
| Space group number |
4 |
| Hermann-Mauguin space group symbol |
P 1 21 1 |
| Hall space group symbol |
P 2yb |
| Residual factor for all reflections |
0.0438 |
| Residual factor for significantly intense reflections |
0.0346 |
| Weighted residual factors for significantly intense reflections |
0.0689 |
| Weighted residual factors for all reflections included in the refinement |
0.0712 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.054 |
| 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/7134615.html
