Information card for entry 1576331

Structure parameters

• Formula: C45 H42 B F9 N4 O
• Calculated formula: C45 H42 B F9 N4 O
• Title of publication: N-centered, yet Persistent: Isolation of N2O-Based Radicals through FLP-type Stabilization
• Authors of publication: Orellana Ben Amor, Andrea; Vendier, Laure; Cesar, Vincent; Maurel, Vincent; Panetier, Julien Andre; Queyriaux, Nicolas
• Journal of publication: Chemical Science
• Year of publication: 2025
• a: 12.504 ± 0.0001 Å
• b: 17.8222 ± 0.0002 Å
• c: 19.7591 ± 0.0002 Å
• α: 90°
• β: 97.49 ± 0.001°
• γ: 90°
• Cell volume: 4365.72 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0421
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0956
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No