Information card for entry 1555650

Structure parameters

• Formula: C16 H12 N2 O
• Calculated formula: C16 H12 N2 O
• Title of publication: Rhodium-Catalyzed C6-Selective C-H Borylation of 2-Pyridones.
• Authors of publication: Miura, Wataru; Hirano, Koji; Miura, Masahiro
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 15
• Pages of publication: 3742 - 3745
• a: 8.41 ± 0.01 Å
• b: 11.941 ± 0.014 Å
• c: 13.209 ± 0.016 Å
• α: 74.04 ± 0.02°
• β: 89.25 ± 0.03°
• γ: 85.17 ± 0.03°
• Cell volume: 1271 ± 3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections included in the refinement: 0.1707
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No