Information card for entry 4003298
| Formula |
C3 H10 Cl3 N Sn |
| Calculated formula |
C3 H9 Cl3 N Sn |
| Title of publication |
Crystallographic Investigations into Properties of Acentric Hybrid Perovskite Single Crystals NH(CH3)3SnX3 (X = Cl, Br) |
| Authors of publication |
Dang, Yangyang; Zhong, Cheng; Zhang, Guodong; Ju, Dianxing; Wang, Lei; Xia, Shengqing; Xia, Haibing; Tao, Xutang |
| Journal of publication |
Chemistry of Materials |
| Year of publication |
2016 |
| Journal volume |
28 |
| Journal issue |
19 |
| Pages of publication |
6968 |
| a |
9.598 ± 0.005 Å |
| b |
8.368 ± 0.005 Å |
| c |
12.416 ± 0.005 Å |
| α |
90 ± 0.005° |
| β |
90 ± 0.005° |
| γ |
90 ± 0.005° |
| Cell volume |
997.2 ± 0.9 Å3 |
| Cell temperature |
420 K |
| Ambient diffraction temperature |
420 K |
| Number of distinct elements |
5 |
| Space group number |
36 |
| Hermann-Mauguin space group symbol |
C m c 21 |
| Hall space group symbol |
C 2c -2 |
| Residual factor for all reflections |
0.0357 |
| Residual factor for significantly intense reflections |
0.0262 |
| Weighted residual factors for significantly intense reflections |
0.0611 |
| Weighted residual factors for all reflections included in the refinement |
0.0672 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.043 |
| Diffraction radiation wavelength |
0.71069 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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