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Information card for entry 7056458
Preview
| Coordinates | 7056458.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H5.75 I22 N12 O3 Pb5 |
|---|---|
| Calculated formula | C36 H60 I22 N12 O3 Pb5 |
| Title of publication | Reversible solid-state thermochromism of a 2D organic-inorganic hybrid perovskite structure based on iodoplumbate and 2-aminomethyl-pyridine |
| Authors of publication | Yu, Hui; Wei, Zhenhong; Hao, Yanhuan; Liang, Zhiwen; Fu, Zhengjiang; Cai, Hu |
| Journal of publication | New J. Chem. |
| Year of publication | 2017 |
| a | 26.628 ± 0.006 Å |
| b | 12.917 ± 0.003 Å |
| c | 26.346 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 9062 ± 4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0593 |
| Residual factor for significantly intense reflections | 0.0446 |
| Weighted residual factors for significantly intense reflections | 0.1257 |
| Weighted residual factors for all reflections included in the refinement | 0.147 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 199337 (current) | 2017-07-26 | cif/ Adding structures of 7056458 via cif-deposit CGI script. |
7056458.cif |
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Users of the data should acknowledge the original authors of the
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