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Information card for entry 7241117
Preview
| Coordinates | 7241117.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | C17H30N3I7Pb2 |
|---|---|
| Formula | C17 H30 I7 N3 Pb2 |
| Calculated formula | C7 I7 N2 Pb2 |
| Title of publication | Layered Hybrid Lead Perovskite Single Crystals: Phase Transformations and Tunable Optical Properties |
| Authors of publication | Song, Jiewu; Dang, Yangyang; Liu, Xiaolong; Tao, Xutang |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 8.8092 ± 0.0005 Å |
| b | 8.8168 ± 0.0004 Å |
| c | 22.8196 ± 0.0012 Å |
| α | 97.072 ± 0.004° |
| β | 93.983 ± 0.004° |
| γ | 90.199 ± 0.004° |
| Cell volume | 1754.51 ± 0.16 Å3 |
| Cell temperature | 296 ± 0.1 K |
| Ambient diffraction temperature | 296 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0747 |
| Residual factor for significantly intense reflections | 0.0546 |
| Weighted residual factors for significantly intense reflections | 0.1443 |
| Weighted residual factors for all reflections included in the refinement | 0.1592 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 255644 (current) | 2020-08-26 | cif/ Adding structures of 7241115, 7241116, 7241117, 7241118, 7241119 via cif-deposit CGI script. |
7241117.cif |
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Users of the data should acknowledge the original authors of the
structural data.