Information card for entry 1569278

Structure parameters

• Formula: C4 H11 Br6 N3 Pb2
• Calculated formula: C3 H10.5 Br6 N3.856 Pb2
• Title of publication: Using Imidazolium in the Construction of Hybrid 2D and 3D Lead Bromide Pseudoperovskites
• Authors of publication: García-Espejo, Gonzalo; Konidaris, Konstantis F.; Guagliardi, Antonietta; Masciocchi, Norberto
• Journal of publication: Chemistry
• Year of publication: 2023
• Journal volume: 5
• Journal issue: 2
• Pages of publication: 1329 - 1343
• a: 9.0885 ± 0.0001 Å
• b: 9.0885 ± 0.0001 Å
• c: 13.8787 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 992.805 ± 0.017 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor R(I) for significantly intense reflections: 0.089
• Goodness-of-fit parameter for all reflections: 12.7
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No