Information card for entry 7157119

Structure parameters

• Formula: C43 H54 N2 O7
• Calculated formula: C43 H54 N2 O7
• Title of publication: The synthesis of solasodine F-homo-analogues.
• Authors of publication: Kiełczewska, Urszula; Morzycki, Jacek W.; Rárová, Lucie; Wojtkielewicz, Agnieszka
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2019
• Journal volume: 17
• Journal issue: 40
• Pages of publication: 9050 - 9058
• a: 6.2833 ± 0.00003 Å
• b: 33.99155 ± 0.00012 Å
• c: 8.90762 ± 0.00005 Å
• α: 90°
• β: 107.114 ± 0.0005°
• γ: 90°
• Cell volume: 1818.25 ± 0.016 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0268
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.0679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No