Information card for entry 4116182

Structure parameters

• Formula: C21 H17 N O2
• Calculated formula: C21 H17 N O2
• Title of publication: Absolute Asymmetric Phthalide Synthesis via the Solid-State Photoreaction of N,N-Disubstituted 2-Benzoylbenzamides Involving a Radical Pair Intermediate
• Authors of publication: Masami Sakamoto; Norio Sekine; Hiroko Miyoshi; Takashi Mino; Tsutomu Fujita
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2000
• Journal volume: 122
• Pages of publication: 10210 - 10211
• a: 11.453 ± 0.003 Å
• b: 18.572 ± 0.005 Å
• c: 8.107 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1724.4 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.044
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No