Information card for entry 7238757

Structure parameters

• Formula: C10 H5 B Cl4 F2 N2 O
• Calculated formula: C10 H5 B Cl4 F2 N2 O
• Title of publication: meso-Alkoxy BODIPYs with a good balance between larger Stokes shifts and higher fluorescence quantum yields
• Authors of publication: Wang, Lu; Zhang, Yuhui; Xiao, Yi
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 7
• Pages of publication: 2203
• a: 9.8376 ± 0.0014 Å
• b: 9.1284 ± 0.0012 Å
• c: 15.0458 ± 0.0019 Å
• α: 90°
• β: 95.922 ± 0.009°
• γ: 90°
• Cell volume: 1343.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0475
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1159
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No