Information card for entry 7150438

Structure parameters

• Formula: C28 H39 N O6 Si
• Calculated formula: C28 H39 N O6 Si
• Title of publication: Investigation of a route to ibotenic acid analogues via a reduced pyroglutamate template.
• Authors of publication: Ahmed, Omar; Hitchcock, Peter B.; Young, Douglas W.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2006
• Journal volume: 4
• Journal issue: 8
• Pages of publication: 1596 - 1603
• a: 7.6412 ± 0.0004 Å
• b: 11.8424 ± 0.0009 Å
• c: 15.8245 ± 0.0007 Å
• α: 90°
• β: 102.434 ± 0.003°
• γ: 90°
• Cell volume: 1398.37 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.0945
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No