Information card for entry 7153803

Structure parameters

• Formula: C14 H20 O4
• Calculated formula: C14 H20 O4
• Title of publication: Concise synthesis of the C-1-C-12 fragment of amphidinolides T1-T5.
• Authors of publication: Clark, J. Stephen; Labre, Flavien; Thomas, Lynne H.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2011
• Journal volume: 9
• Journal issue: 13
• Pages of publication: 4823 - 4830
• a: 5.2851 ± 0.0001 Å
• b: 15.1376 ± 0.0004 Å
• c: 8.295 ± 0.0002 Å
• α: 90°
• β: 94.61 ± 0.001°
• γ: 90°
• Cell volume: 661.48 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0577
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for all reflections included in the refinement: 0.0866
• Goodness-of-fit parameter for all reflections included in the refinement: 0.939
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No