Information card for entry 4516200

Structure parameters

• Formula: C1.4 H6.2 I3 N1.6 O0.4 Sn
• Calculated formula: C2.01 I3 N1.34 Sn
• Title of publication: Control of Crystal Structures and Optical Properties with Hybrid Formamidinium and 2-Hydroxyethylammonium Cations for Mesoscopic Carbon-Electrode Tin-Based Perovskite Solar Cells
• Authors of publication: Tsai, Cheng-Min; Lin, Yu-Pei; Pola, Murali Krishna; Narra, Sudhakar; Jokar, Efat; Yang, Yaw-Wen; Diau, Eric Wei-Guang
• Journal of publication: ACS Energy Letters
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 9
• Pages of publication: 2077
• a: 8.92 ± 0.004 Å
• b: 8.92 ± 0.004 Å
• c: 10.934 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 753.4 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0844
• Residual factor for significantly intense reflections: 0.0802
• Weighted residual factors for significantly intense reflections: 0.2229
• Weighted residual factors for all reflections included in the refinement: 0.2287
• Goodness-of-fit parameter for all reflections included in the refinement: 1.296
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No