Information card for entry 1551987

Structure parameters

• Formula: C32 H24 N2 O3
• Calculated formula: C32 H24 N2 O3
• Title of publication: A sterically encumbered photoredox catalyst enables the unified synthesis of the classical lignan family of natural products
• Authors of publication: Alfonzo, Edwin; Beeler, Aaron B.
• Journal of publication: Chemical Science
• Year of publication: 2019
• a: 29.638 ± 0.003 Å
• b: 9.9154 ± 0.0009 Å
• c: 17.199 ± 0.002 Å
• α: 90°
• β: 102.137 ± 0.008°
• γ: 90°
• Cell volume: 4941.3 ± 0.9 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 4
• 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: 0.0876
• Residual factor for significantly intense reflections: 0.0752
• Weighted residual factors for significantly intense reflections: 0.205
• Weighted residual factors for all reflections included in the refinement: 0.2197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No