Information card for entry 4105126

Structure parameters

• Formula: C28 H33 N O10
• Calculated formula: C28 H33 N O10
• Title of publication: Catalytic Asymmetric Synthesis of Palmerolide A via Organoboron Methodology
• Authors of publication: Marlin Penner; Vivek Rauniyar; Ludwig T. Kaspar; Dennis G. Hall
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 14216 - 14217
• a: 5.0947 ± 0.0009 Å
• b: 22.762 ± 0.004 Å
• c: 24.163 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2802.1 ± 0.8 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1255
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No