Information card for entry 1545319

Structure parameters

• Formula: C H5 Br3 N2 Pb
• Calculated formula: C0.9984 H3.9936 Br3 N1.9968 Pb
• Title of publication: Unbalanced Hole and Electron Diffusion in Lead Bromide Perovskites.
• Authors of publication: Elbaz, Giselle A.; Straus, Daniel B.; Semonin, Octavi E.; Hull, Trevor D.; Paley, Daniel W.; Kim, Philip; Owen, Jonathan S.; Kagan, Cherie R.; Roy, Xavier
• Journal of publication: Nano letters
• Year of publication: 2017
• Journal volume: 17
• Journal issue: 3
• Pages of publication: 1727 - 1732
• a: 5.96976 ± 0.00019 Å
• b: 5.96976 ± 0.00019 Å
• c: 5.96976 ± 0.00019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 212.751 ± 0.012 ų
• Cell temperature: 300.3 ± 0.4 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 5
• Space group number: 221
• Hermann-Mauguin space group symbol: P m -3 m
• Hall space group symbol: -P 4 2 3
• Residual factor for all reflections: 0.0266
• Residual factor for significantly intense reflections: 0.0213
• Weighted residual factors for significantly intense reflections: 0.0461
• Weighted residual factors for all reflections included in the refinement: 0.0537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.265
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No