Information card for entry 4002667

Structure parameters

• Formula: C14 H20 I4 N2 Pb
• Calculated formula: C14 H20 I4 N2 Pb
• Title of publication: Confinement Effects in Low-Dimensional Lead Iodide Perovskite Hybrids
• Authors of publication: Kamminga, Machteld E.; Fang, Hong-Hua; Filip, Marina R.; Giustino, Feliciano; Baas, Jacob; Blake, Graeme R.; Loi, Maria Antonietta; Palstra, Thomas T. M.
• Journal of publication: Chemistry of Materials
• Year of publication: 2016
• Journal volume: 28
• Journal issue: 13
• Pages of publication: 4554
• a: 9.1111 ± 0.0003 Å
• b: 8.6338 ± 0.0003 Å
• c: 28.408 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2234.67 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0183
• Residual factor for significantly intense reflections: 0.0173
• Weighted residual factors for significantly intense reflections: 0.0428
• Weighted residual factors for all reflections included in the refinement: 0.0435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No