Information card for entry 7238956

Structure parameters

• Formula: C28 H24 N2 O
• Calculated formula: C28 H24 N2 O
• Title of publication: Three-component domino reactions providing rapid and efficient routes to fully substituted pyrroles
• Authors of publication: Liu, Jia-Yan; Li, Qiu-Yun; Jiang, Bo; Tu, Shu-Jiang
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 15
• Pages of publication: 5056
• a: 8.0693 ± 0.0008 Å
• b: 14.737 ± 0.0013 Å
• c: 18.6512 ± 0.0018 Å
• α: 90°
• β: 93.62 ± 0.001°
• γ: 90°
• Cell volume: 2213.5 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0883
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.1461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No