Information card for entry 7212961

Structure parameters

• Formula: C28 H48 O4
• Calculated formula: C28 H48 O4
• Title of publication: Conformational studies of two new brassinosteroid analogues with a 22,23-trans diol function
• Authors of publication: Drosihn, Susanne; Porzel, Andrea; Voigt, Brunhilde; Brandt, Wolfgang; Wagner, Christoph; Merzweiler, Kurt; Adam, Günter
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 2
• Year of publication: 1999
• Journal issue: 2
• Pages of publication: 233
• a: 7.8955 ± 0.0017 Å
• b: 11.486 ± 0.002 Å
• c: 28.835 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2615 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.0442
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No