Information card for entry 8000480

Structure parameters

• Formula: C19 H22 Bi Cl6 F N3 O6
• Calculated formula: C19 H28 Bi Cl6 F N3 O6
• Title of publication: Role of Metal-Chloride Anions in Photoluminescence Regulations for Hybrid Metal Halides.
• Authors of publication: Su, Binbin; Song, Gaomin; Molokeev, Maxim S.; Golovnev, Nicolay N.; Lesnikov, Maxim K.; Lin, Zheshuai; Xia, Zhiguo
• Journal of publication: The journal of physical chemistry letters
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 7
• Pages of publication: 1918 - 1925
• a: 7.987 ± 0.003 Å
• b: 14.188 ± 0.005 Å
• c: 14.544 ± 0.005 Å
• α: 70.746 ± 0.008°
• β: 89.925 ± 0.009°
• γ: 76.317 ± 0.009°
• Cell volume: 1506.5 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1163
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.1503
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 0.896
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No