Information card for entry 7015449

Structure parameters

• Formula: C H6 I3 N Sn
• Calculated formula: I3 Sn
• Title of publication: Charge-transport in tin-iodide perovskite CH(3)NH(3)SnI(3): origin of high conductivity.
• Authors of publication: Takahashi, Yukari; Obara, Rena; Lin, Zheng-Zhong; Takahashi, Yukihiro; Naito, Toshio; Inabe, Tamotsu; Ishibashi, Shoji; Terakura, Kiyoyuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 20
• Pages of publication: 5563 - 5568
• a: 8.7271 ± 0.0008 Å
• b: 8.7271 ± 0.0008 Å
• c: 12.5022 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 952.2 ± 0.17 ų
• Cell temperature: 140.1 K
• Ambient diffraction temperature: 140 K
• Number of distinct elements: 5
• Space group number: 140
• Hermann-Mauguin space group symbol: I 4/m c m
• Hall space group symbol: -I 4 2c
• Residual factor for significantly intense reflections: 0.0573
• Weighted residual factors for all reflections included in the refinement: 0.2681
• Goodness-of-fit parameter for all reflections included in the refinement: 0.914
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No