Information card for entry 1576325

Structure parameters

• Formula: C19 H19 B N2 O2
• Calculated formula: C19 H19 B N2 O2
• Title of publication: The Dynamic Chemistry of the Boron-Nitrogen Bond
• Authors of publication: Frateloreto, Federico; Capocasa, Giorgio; De Angelis, Martina; Sandri, Greta; Lanzalunga, Osvaldo; Massera, Chiara; Di Stefano, Stefano
• Journal of publication: Chemical Science
• Year of publication: 2025
• a: 10.3502 ± 0.0003 Å
• b: 12.7006 ± 0.0003 Å
• c: 16.1326 ± 0.0004 Å
• α: 95.418 ± 0.002°
• β: 92.689 ± 0.002°
• γ: 98.505 ± 0.002°
• Cell volume: 2084 ± 0.09 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1183
• Residual factor for significantly intense reflections: 0.0989
• Weighted residual factors for significantly intense reflections: 0.2446
• Weighted residual factors for all reflections included in the refinement: 0.2557
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No