Information card for entry 1572934

Structure parameters

• Formula: C20 H11 B S3
• Calculated formula: C20 H11 B S3
• Title of publication: Multi-Resonance Emitters with Room Temperature Phosphorescence in Amorphous State and Excited by Visible Light
• Authors of publication: Du, Baoyun; Wu, Yuliang; Wang, Xingdong; Tian, Hongkun; Shao, Shiyang; Wang, Lixiang
• Journal of publication: Chemical Science
• Year of publication: 2024
• a: 18.0631 ± 0.0008 Å
• b: 7.556 ± 0.0003 Å
• c: 22.9236 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3128.7 ± 0.2 ų
• Cell temperature: 281 ± 2 K
• Ambient diffraction temperature: 281 ± 2 K
• Number of distinct elements: 4
• 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: 0.0371
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0832
• Weighted residual factors for all reflections included in the refinement: 0.0893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No