Information card for entry 8000478

Structure parameters

• Formula: C19 H24 Cl6 F N3 O4 Sn
• Calculated formula: C19 H26 Cl6 F N3 O4 Sn
• SMILES: [Sn](Cl)(Cl)(Cl)([Cl-])(Cl)[Cl-].Fc1c(cc2c(c1)c(c(c[n+]2C1CC1)C(=O)O)O)N1CC[NH+](CC1)CC.O
• 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: 17.1753 ± 0.001 Å
• b: 10.1401 ± 0.0006 Å
• c: 17.1948 ± 0.001 Å
• α: 90°
• β: 119.018 ± 0.0013°
• γ: 90°
• Cell volume: 2618.7 ± 0.3 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0966
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for significantly intense reflections: 0.1324
• Weighted residual factors for all reflections included in the refinement: 0.1428
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No