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Information card for entry 4345114
Preview
| Coordinates | 4345114.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Guanidinium Tin Iodide |
|---|---|
| Formula | C H6 I3 N3 Sn |
| Calculated formula | C H6 I3 N3 Sn |
| Title of publication | Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites. |
| Authors of publication | Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2017 |
| Journal volume | 56 |
| Journal issue | 1 |
| Pages of publication | 56 - 73 |
| a | 9.3044 ± 0.0004 Å |
| b | 21.1918 ± 0.001 Å |
| c | 18.5797 ± 0.0007 Å |
| α | 90° |
| β | 119.962 ± 0.003° |
| γ | 90° |
| Cell volume | 3173.9 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0818 |
| Residual factor for significantly intense reflections | 0.0542 |
| Weighted residual factors for significantly intense reflections | 0.0825 |
| Weighted residual factors for all reflections included in the refinement | 0.089 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.102 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 191262 (current) | 2017-02-04 | cif/ Adding structures of 4345114, 4345115 via cif-deposit CGI script. |
4345114.cif |
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