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Information card for entry 4003643
Preview
| Coordinates | 4003643.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C H6 Au I3 N |
|---|---|
| Calculated formula | C H6 Au I3 N |
| Title of publication | Direct Band Gap Mixed-Valence Organic‒inorganic Gold Perovskite as Visible Light Absorbers |
| Authors of publication | Ghosh, Biplab; Febriansyah, Benny; Harikesh, Padinhare Cholakkal; Koh, Teck Ming; Hadke, Shreyash; Wong, Lydia H.; England, Jason; Mhaisalkar, Subodh G.; Mathews, Nripan |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2020 |
| a | 8.3537 ± 0.0004 Å |
| b | 8.3537 ± 0.0004 Å |
| c | 24.6556 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1720.57 ± 0.15 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 96 |
| Hermann-Mauguin space group symbol | P 43 21 2 |
| Hall space group symbol | P 4nw 2abw |
| Residual factor for all reflections | 0.0277 |
| Residual factor for significantly intense reflections | 0.0249 |
| Weighted residual factors for significantly intense reflections | 0.0507 |
| Weighted residual factors for all reflections included in the refinement | 0.052 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 254655 (current) | 2020-07-30 | cif/ Adding structures of 4003643 via cif-deposit CGI script. |
4003643.cif |
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