Information card for entry 4503566

Structure parameters

• Formula: C5.33 H8 Br3.56 N2.67 Pb0.89
• Calculated formula: C5.33333 H8 Br3.55556 N2.66667 Pb0.888889
• Title of publication: New Organic‒Inorganic Perovskite Materials with Different Optical Properties Modulated by Different Inorganic Sheets
• Authors of publication: Li, Yinyan; Zheng, Guoli; Lin, Cuikun; Lin, Jun
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 6
• Pages of publication: 1990
• a: 16.8125 ± 0.0009 Å
• b: 8.4528 ± 0.0004 Å
• c: 19.4257 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2760.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0752
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.0818
• Weighted residual factors for all reflections included in the refinement: 0.0924
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No