Information card for entry 7237313

Structure parameters

• Formula: C5 H15 Cl4 N2 O Pb
• Calculated formula: C5 H15 Cl4 N2 O Pb
• Title of publication: White-light emission in a chiral one-dimensional organic‒inorganic hybrid perovskite
• Authors of publication: Peng, Yu; Yao, Yunpeng; Li, Lina; Wu, Zhenyue; Wang, Sasa; Luo, Junhua
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 22
• Pages of publication: 6033
• a: 5.9285 ± 0.0003 Å
• b: 14.3929 ± 0.0008 Å
• c: 15.8658 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1353.8 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0849
• Weighted residual factors for all reflections included in the refinement: 0.0868
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No