Information card for entry 1563711

Structure parameters

• Formula: C8 H10 F4 I4 N2 Pb
• Calculated formula: C8 H10 F4 I4 N2 Pb
• Title of publication: Multiple-Noncovalent-Interaction-Stabilized Layered Dion-Jacobson Perovskite for Efficient Solar Cells.
• Authors of publication: Lv, Guangwei; Li, Ling; Lu, Di; Xu, Zhiyuan; Dong, Yixin; Li, Qiaohui; Chang, Zhitao; Yin, Wan-Jian; Liu, Yongsheng
• Journal of publication: Nano letters
• Year of publication: 2021
• a: 13.0661 ± 0.0004 Å
• b: 8.5368 ± 0.0003 Å
• c: 8.5165 ± 0.0003 Å
• α: 90°
• β: 97.942 ± 0.001°
• γ: 90°
• Cell volume: 940.84 ± 0.06 ų
• Cell temperature: 210 ± 2 K
• Ambient diffraction temperature: 210 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.1028
• Weighted residual factors for all reflections included in the refinement: 0.1032
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No