Information card for entry 7237615

Structure parameters

• Formula: C22 H25 B F2 N2
• Calculated formula: C22 H25 B F2 N2
• Title of publication: Bright solid-state red-emissive BODIPYs: facile synthesis and their high-contrast mechanochromic properties
• Authors of publication: Duan, Chong; Zhou, Yibin; Shan, Guo-Gang; Chen, Yuncong; Zhao, Weijun; Yuan, Dandan; Zeng, Lintao; Huang, Xiaobo; Niu, Guangle
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 12
• Pages of publication: 3471
• a: 7.8705 ± 0.0003 Å
• b: 13.512 ± 0.0006 Å
• c: 19.4137 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2064.57 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0513
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0896
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No