Information card for entry 4031723

Structure parameters

• Formula: C24 H26 N2 O3
• Calculated formula: C24 H26 N2 O3
• Title of publication: Multicomponent/Palladium-Catalyzed Cascade Entry to Benzopyrrolizidine Derivatives: Synthesis and Antioxidant Evaluation.
• Authors of publication: Miranda, Luis D.; Hernández-Vázquez, Eduardo
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2015
• Journal volume: 80
• Journal issue: 21
• Pages of publication: 10611 - 10623
• a: 8.749 ± 0.005 Å
• b: 10.924 ± 0.006 Å
• c: 11.952 ± 0.007 Å
• α: 104.251 ± 0.01°
• β: 92.232 ± 0.01°
• γ: 101.63 ± 0.01°
• Cell volume: 1079.7 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1515
• Residual factor for significantly intense reflections: 0.0843
• Weighted residual factors for significantly intense reflections: 0.2167
• Weighted residual factors for all reflections included in the refinement: 0.2647
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No