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Information card for entry 1567407
Preview
Coordinates | 1567407.cif |
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Original paper (by DOI) | HTML |
Formula | C9 H13 Br4 N3 Pb |
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Calculated formula | C8.9999 H12.9993 Br4 N2.9999 Pb |
Title of publication | Reliably obtaining white light from layered halide perovskites at room temperature |
Authors of publication | Crace, Ethan; Su, Alexander; Karunadasa, Hemamala I. |
Journal of publication | Chemical Science |
Year of publication | 2022 |
a | 12.0291 ± 0.0002 Å |
b | 31.112 ± 0.0007 Å |
c | 8.7353 ± 0.0002 Å |
α | 90° |
β | 94.059 ± 0.001° |
γ | 90° |
Cell volume | 3260.98 ± 0.12 Å3 |
Cell temperature | 300 K |
Ambient diffraction temperature | 300.15 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.038 |
Residual factor for significantly intense reflections | 0.0296 |
Weighted residual factors for significantly intense reflections | 0.0684 |
Weighted residual factors for all reflections included in the refinement | 0.073 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
277025 (current) | 2022-08-02 | cif/ Adding structures of 1567406, 1567407, 1567408, 1567409, 1567410, 1567411, 1567412, 1567413 via cif-deposit CGI script. |
1567407.cif |
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