Information card for entry 1569979

Structure parameters

• Formula: C29 H34 B F2 N4 O2
• Calculated formula: C29 H34 B F2 N4 O2
• Title of publication: Visible light activated energy storage in solid-state Azo-BF₂ switches.
• Authors of publication: Qiu, Qianfeng; Qi, Qingkai; Usuba, Junichi; Lee, Karina; Aprahamian, Ivan; Han, Grace G. D.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 41
• Pages of publication: 11359 - 11364
• a: 7.2509 ± 0.0003 Å
• b: 41.2972 ± 0.0009 Å
• c: 9.738 ± 0.0002 Å
• α: 90.122 ± 0.002°
• β: 109.885 ± 0.003°
• γ: 89.203 ± 0.003°
• Cell volume: 2741.83 ± 0.15 ų
• Cell temperature: 100 ± 0.3 K
• Ambient diffraction temperature: 100 ± 0.3 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0783
• Weighted residual factors for significantly intense reflections: 0.2231
• Weighted residual factors for all reflections included in the refinement: 0.2356
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No