Information card for entry 7130350
Formula |
C35 H80 Br15 N10 Rb5 |
Calculated formula |
C35 H80 Br15 N10 Rb5 |
Title of publication |
Precise design and preparation of two 3D organic−inorganic perovskite ferroelectrics (1,5-diazabicyclo[3.2.2]nonane)RbX3 (X = Br, I) |
Authors of publication |
Han, Keke; Zhang, Mengxia; Wei, Zhenhong; Ye, Xing; Rao, Wenjun; Zhang, Haina; Cai, Hu |
Journal of publication |
Chemical Communications |
Year of publication |
2022 |
a |
48.9591 ± 0.0006 Å |
b |
6.8436 ± 0.0001 Å |
c |
9.8667 ± 0.0001 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
3305.9 ± 0.07 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
5 |
Space group number |
31 |
Hermann-Mauguin space group symbol |
P m n 21 |
Hall space group symbol |
P 2ac -2 |
Residual factor for all reflections |
0.0628 |
Residual factor for significantly intense reflections |
0.0611 |
Weighted residual factors for significantly intense reflections |
0.1595 |
Weighted residual factors for all reflections included in the refinement |
0.1617 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.019 |
Diffraction radiation wavelength |
1.54178 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/7130350.html