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Information card for entry 4134350
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Coordinates | 4134350.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H20 I4 N2 Pb |
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Calculated formula | C14 H20 I4 N2 Pb |
Title of publication | Control of crystal symmetry breaking with halogen substituted benzylammonium in layered hybrid metal-halide perovskites. |
Authors of publication | Schmitt, Tanja; Bourelle, Sean; Tye, Nathaniel; Soavi, Giancarlo; Bond, Andrew D.; Feldmann, Sascha; Traore, Boubacar; Katan, Claudine; Even, Jacky; Dutton, Siân E; Deschler, Felix |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2020 |
a | 9.1437 ± 0.0002 Å |
b | 8.6684 ± 0.0002 Å |
c | 28.5984 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2266.74 ± 0.08 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0435 |
Residual factor for significantly intense reflections | 0.029 |
Weighted residual factors for significantly intense reflections | 0.0523 |
Weighted residual factors for all reflections included in the refinement | 0.0561 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4134350.html
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