Information card for entry 7124438

Structure parameters

• Formula: C38 H24 O3
• Calculated formula: C38 H24 O3
• Title of publication: Palladium-catalysed enol/enolate directed oxidative annulation: functionalized naphthofuroquinones synthesis and bioactivity evaluation
• Authors of publication: Wang, Lei; Lv, Shuaipeng; Liu, Haitao; Kang, Jie; Luo, Yun; Gong, Ting; Dong, Zhengqi; Sun, Guibo; He, Chun-nian; Sun, Xiaobo
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 8.4942 ± 0.0008 Å
• b: 10.2513 ± 0.0009 Å
• c: 15.9443 ± 0.0015 Å
• α: 94.831 ± 0.001°
• β: 96.681 ± 0.001°
• γ: 104.819 ± 0.001°
• Cell volume: 1323.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.048
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1159
• Weighted residual factors for all reflections included in the refinement: 0.1219
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No