Information card for entry 8000428

Structure parameters

• Formula: C8 H20 Br4 N2 Pb
• Calculated formula: C8 H20 Br4 N2 Pb
• Title of publication: Unveiling Mn²⁺ Dopant States in Two-Dimensional Halide Perovskite toward Highly Efficient Photoluminescence.
• Authors of publication: Su, Binbin; Molokeev, Maxim S.; Xia, Zhiguo
• Journal of publication: The journal of physical chemistry letters
• Year of publication: 2020
• Journal volume: 11
• Journal issue: 7
• Pages of publication: 2510 - 2517
• a: 8.4804 ± 0.0002 Å
• b: 24.4406 ± 0.0006 Å
• c: 7.9107 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1639.62 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0302
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0861
• Weighted residual factors for all reflections included in the refinement: 0.0863
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No