Information card for entry 7232821

Structure parameters

• Formula: C25 H29 B N2 O3
• Calculated formula: C25 H29 B N2 O3
• Title of publication: Solid-state emissive O-BODIPY dyes with bimodal emissions across red and near infrared region
• Authors of publication: El-Ali, H. A. Abdulhadi; Jing, Jing; Zhang, Xiaoling
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 28
• Pages of publication: 16246
• a: 12.5136 ± 0.0006 Å
• b: 7.6846 ± 0.0003 Å
• c: 23.2996 ± 0.0012 Å
• α: 90°
• β: 96.257 ± 0.002°
• γ: 90°
• Cell volume: 2227.19 ± 0.18 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0994
• Residual factor for significantly intense reflections: 0.0722
• Weighted residual factors for significantly intense reflections: 0.1934
• Weighted residual factors for all reflections included in the refinement: 0.2225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No