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Information card for entry 4003558
Preview
| Coordinates | 4003558.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H24 Br4 N2 Sn |
|---|---|
| Calculated formula | C16 H24 Br4 N2 Sn |
| SMILES | [Sn](Br)(Br)[Br-].[Br-].[NH3+]CCc1ccccc1.[NH3+]CCc1ccccc1 |
| Title of publication | 0D and 2D: The Cases of Phenylethylammonium Tin Bromide Hybrids |
| Authors of publication | Xu, Liang-Jin; Lin, Haoran; Lee, Sujin; Zhou, Chenkun; Worku, Michael; Chaaban, Maya; He, Qingquan; Plaviak, Anna; Lin, Xinsong; Chen, Banghao; Du, Mao-Hua; Ma, Biwu |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2020 |
| a | 11.5583 ± 0.0006 Å |
| b | 11.6234 ± 0.0005 Å |
| c | 17.3131 ± 0.0007 Å |
| α | 80.299 ± 0.004° |
| β | 74.26 ± 0.004° |
| γ | 89.849 ± 0.004° |
| Cell volume | 2204.45 ± 0.18 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0479 |
| Residual factor for significantly intense reflections | 0.0393 |
| Weighted residual factors for significantly intense reflections | 0.1038 |
| Weighted residual factors for all reflections included in the refinement | 0.1099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.946 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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The link is: https://www.crystallography.net/4003558.html
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