Information card for entry 4133146

Structure parameters

• Formula: C18 H48 Br10 N6 Pb2
• Calculated formula: C18 H48 Br10 N6 Pb2
• Title of publication: Structural Diversity in White-Light-Emitting Hybrid Lead Bromide Perovskites.
• Authors of publication: Mao, Lingling; Guo, Peijun; Kepenekian, Mikaël; Hadar, Ido; Katan, Claudine; Even, Jacky; Schaller, Richard D.; Stoumpos, Constantinos C.; Kanatzidis, Mercouri G.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 40
• Pages of publication: 13078 - 13088
• a: 6.2455 ± 0.0004 Å
• b: 16.8901 ± 0.001 Å
• c: 20.1013 ± 0.0011 Å
• α: 73.597 ± 0.003°
• β: 84.96 ± 0.003°
• γ: 88.793 ± 0.003°
• Cell volume: 2026.2 ± 0.2 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 249.96 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: 0.0441
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0847
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No