Information card for entry 1507620

Structure parameters

• Formula: C24 H19 N O2
• Calculated formula: C24 H19 N O2
• SMILES: N1(c2c3cc(oc3ccc2CCC1=O)c1ccccc1)c1ccc(cc1)C
• Title of publication: Application of dearomatization strategy on the synthesis of furoquinolinone and angelicin derivatives.
• Authors of publication: Ye, Yang; Zhang, Li; Fan, Renhua
• Journal of publication: Organic letters
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 8
• Pages of publication: 2114 - 2117
• a: 11.316 ± 0.004 Å
• b: 5.8089 ± 0.0019 Å
• c: 27.45 ± 0.009 Å
• α: 90°
• β: 92.831 ± 0.004°
• γ: 90°
• Cell volume: 1802.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0812
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1308
• Weighted residual factors for all reflections included in the refinement: 0.1435
• Goodness-of-fit parameter for all reflections included in the refinement: 0.927
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No