Information card for entry 7205002

Structure parameters

• Formula: C26 H38 O7
• Calculated formula: C26 H38 O7
• Title of publication: Exploitation of chemical predisposition in synthesis: an approach to the manzamenones
• Authors of publication: Al-Busafi, Saleh; Doncaster, Jeremy R.; Drew, Michael G. B.; Regan, Andrew C.; Whitehead, Roger C.
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 1
• Year of publication: 2002
• Journal issue: 4
• Pages of publication: 476
• a: 12.691 ± 0.014 Å
• b: 17.33 ± 0.02 Å
• c: 12.358 ± 0.014 Å
• α: 90°
• β: 93.44 ± 0.01°
• γ: 90°
• Cell volume: 2713 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2319
• Residual factor for significantly intense reflections: 0.1132
• Weighted residual factors for significantly intense reflections: 0.3133
• Weighted residual factors for all reflections included in the refinement: 0.3825
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No