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Information card for entry 4003471
Preview
| Coordinates | 4003471.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C H7 Br3 N2 Pb |
|---|---|
| Calculated formula | C0.9996 Br3 N2.0004 Pb |
| Title of publication | Methylhydrazinium Lead Bromide: Noncentrosymmetric Three-Dimensional Perovskite with Exceptionally Large Framework Distortion and Green Photoluminescence |
| Authors of publication | Ma̧czka, Mirosl̷aw; Ptak, Maciej; Ga̧gor, Anna; Stefańska, Dagmara; Zarȩba, Jan K.; Sieradzki, Adam |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2020 |
| a | 6.0354 ± 0.0004 Å |
| b | 6.0354 ± 0.0004 Å |
| c | 6.0354 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 219.85 ± 0.03 Å3 |
| Cell temperature | 430.01 ± 0.1 K |
| Ambient diffraction temperature | 430.01 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 221 |
| Hermann-Mauguin space group symbol | P m -3 m |
| Hall space group symbol | -P 4 2 3 |
| Residual factor for all reflections | 0.0282 |
| Residual factor for significantly intense reflections | 0.0267 |
| Weighted residual factors for significantly intense reflections | 0.0618 |
| Weighted residual factors for all reflections included in the refinement | 0.0637 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.135 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247899 (current) | 2020-02-06 | cif/ Adding structures of 4003471 via cif-deposit CGI script. |
4003471.cif |
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