Information card for entry 4349804

Structure parameters

• Common name: 1-Methylpiperidinium triiodoplumbate(II)
• Chemical name: 1-Methylpiperidinium triiodoplumbate(II)
• Formula: C12 H27.98 I6 N1.98 Pb2
• Calculated formula: C12 H27.98 I6 N1.98 Pb2
• 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: 16.1575 ± 0.0011 Å
• b: 8.0428 ± 0.0005 Å
• c: 11.0622 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1437.55 ± 0.18 ų
• Cell temperature: 280 ± 2 K
• Ambient diffraction temperature: 280 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0607
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1181
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No