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Information card for entry 7125563
Preview
| Coordinates | 7125563.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H16 I4 N2 Pb S2 |
|---|---|
| Calculated formula | C10 H16 I4 N2 Pb S2 |
| Title of publication | (C4H3SCH2NH3)2(CH3NH3)Pb2I7: non-centrosymmetrical crystal structure of a bilayer hybrid perovskite. |
| Authors of publication | Zhu, Xu-Hui; Mercier, Nicolas; Riou, Amédée; Blanchard, Philippe; Frère, Pierre |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2002 |
| Journal issue | 18 |
| Pages of publication | 2160 - 2161 |
| a | 8.842 ± 0.002 Å |
| b | 8.693 ± 0.001 Å |
| c | 28.995 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2228.7 ± 0.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for significantly intense reflections | 0.0283 |
| Weighted residual factors for all reflections included in the refinement | 0.0841 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.987 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244040 (current) | 2019-11-28 | cif/ Adding structures of 7125562, 7125563 via cif-deposit CGI script. |
7125563.cif |
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Users of the data should acknowledge the original authors of the
structural data.