Information card for entry 4349805

Structure parameters

• Common name: 1-Methylpiperidinium triiodoplumbate(II)
• Chemical name: 1-Methylpiperidinium triiodoplumbate(II)
• Formula: C6 H14 I3 N Pb
• Calculated formula: C6 H14 I3 N Pb
• Title of publication: [C6H14N]PbI3: a one-dimensional perovskite-like order‒disorder phase transition material with semiconducting and switchable dielectric attributes
• Authors of publication: Zeb, Aurang; Sun, Zhihua; Khan, Asma; Zhang, Shuquan; Khan, Tariq; Asghar, Muhammad Adnan; Luo, Junhua
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2018
• Journal volume: 5
• Journal issue: 4
• Pages of publication: 897
• a: 8.0435 ± 0.0008 Å
• b: 15.872 ± 0.0016 Å
• c: 11.0048 ± 0.0013 Å
• α: 90°
• β: 92.088 ± 0.009°
• γ: 90°
• Cell volume: 1404 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1197
• Residual factor for significantly intense reflections: 0.1065
• Weighted residual factors for significantly intense reflections: 0.2949
• Weighted residual factors for all reflections included in the refinement: 0.3182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.239
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No