Information card for entry 1520053

Structure parameters

• Formula: C6 H24 I8 N2 O2 Pb3 S2
• Calculated formula: C6 I8 N2 O2 Pb3 S2
• Title of publication: Solvent engineering towards controlled grain growth in perovskite planar heterojunction solar cells.
• Authors of publication: Rong, Yaoguang; Tang, Zhongjia; Zhao, Yufeng; Zhong, Xin; Venkatesan, Swaminathan; Graham, Harrison; Patton, Matthew; Jing, Yan; Guloy, Arnold M.; Yao, Yan
• Journal of publication: Nanoscale
• Year of publication: 2015
• Journal volume: 7
• Journal issue: 24
• Pages of publication: 10595 - 10599
• a: 4.6212 ± 0.0013 Å
• b: 27.484 ± 0.008 Å
• c: 26.923 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3419.5 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.1237
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.1217
• Goodness-of-fit parameter for all reflections included in the refinement: 0.836
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No