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Information card for entry 2022285
Preview
| Coordinates | 2022285.cif |
|---|---|
| Structure factors | 2022285.hkl |
| Original IUCr paper | HTML |
| Common name | Bis(3-fluorocyclobutylammonium) tetraiodidoplumbate(VI) |
|---|---|
| Chemical name | Poly[bis(3-fluorocyclobutylammonium) [di-μ-iodido-diiodidoplumbate(VI)]] |
| Formula | C8 H18 F2 I4 N2 Pb |
| Calculated formula | C8 H18 F2 I4 N2 Pb |
| Title of publication | A two-dimensional organic‒inorganic lead iodide perovskite: poly[bis(3-fluorocyclobutylammonium) [di-μ-iodido-diiodidoplumbate(VI)]] |
| Authors of publication | Huang, Chao-Ran; Li, Peng-Fei; Luo, Xu-Zhong |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2020 |
| Journal volume | 76 |
| Journal issue | 12 |
| Pages of publication | 1096 - 1099 |
| a | 13.6842 ± 0.0005 Å |
| b | 8.5302 ± 0.0003 Å |
| c | 8.9518 ± 0.0003 Å |
| α | 90° |
| β | 107.996 ± 0.004° |
| γ | 90° |
| Cell volume | 993.81 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0379 |
| Residual factor for significantly intense reflections | 0.0321 |
| Weighted residual factors for significantly intense reflections | 0.0794 |
| Weighted residual factors for all reflections included in the refinement | 0.0815 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259256 (current) | 2020-11-26 | cif/ hkl/ Adding structures of 2022285 via cif-deposit CGI script. |
2022285.cif 2022285.hkl |
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Users of the data should acknowledge the original authors of the
structural data.