Information card for entry 7717704
| Formula |
C16 H28 Br4 N4 O2 Zn |
| Calculated formula |
C16 H28 Br4 N4 O2 Zn |
| Title of publication |
An organic-inorganic hybrid ferroelastic with a near-room-temperature phase transition. |
| Authors of publication |
Bai, Yong-Ju; Qi, Jun-Chao; Hou, Ya-Ru; Xia, Zhang-Tian; Shen, Xin; Peng, Hang; Lu, Yan-Zi; Qin, Yan; Lv, Hui-Peng; Liao, Wei-Qiang |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2024 |
| a |
10.1213 ± 0.0002 Å |
| b |
20.2424 ± 0.0003 Å |
| c |
25.725 ± 0.0005 Å |
| α |
70.636 ± 0.002° |
| β |
86.506 ± 0.001° |
| γ |
89.614 ± 0.001° |
| Cell volume |
4962.62 ± 0.17 Å3 |
| Cell temperature |
233.14 K |
| Ambient diffraction temperature |
233.14 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 |
0.075 |
| Residual factor for significantly intense reflections |
0.0671 |
| Weighted residual factors for significantly intense reflections |
0.1983 |
| Weighted residual factors for all reflections included in the refinement |
0.2052 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.012 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7717704.html
