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Information card for entry 7124241
Preview
| Coordinates | 7124241.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H22 Bi2 I8 N2 O |
|---|---|
| Calculated formula | C8 H22 Bi2 I8 N2 O |
| Title of publication | Tunable Optical Absorption in Lead-Free Perovskite-Like Hybrids by Iodide Management |
| Authors of publication | Kou, Bo; Zhang, WeiChuan; Ji, Chengmin; Wu, Zhenyue; Zhang, Shuhua; Liu, Xitao; Luo, Junhua |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 10.4885 ± 0.0007 Å |
| b | 24.8912 ± 0.0017 Å |
| c | 12.3295 ± 0.0009 Å |
| α | 90° |
| β | 113.343 ± 0.002° |
| γ | 90° |
| Cell volume | 2955.4 ± 0.4 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273.15 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 | 0.0985 |
| Residual factor for significantly intense reflections | 0.0508 |
| Weighted residual factors for significantly intense reflections | 0.0991 |
| Weighted residual factors for all reflections included in the refinement | 0.1134 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 218885 (current) | 2019-09-28 | cif/ Adding structures of 7124240, 7124241, 7124242 via cif-deposit CGI script. |
7124241.cif |
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Users of the data should acknowledge the original authors of the
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