Information card for entry 1559460

Structure parameters

• Common name: Methyl (2S,3S)-3-Triphenylmethylaminooxolan-2-ylacetate
• Formula: C26 H27 N O3
• Calculated formula: C26 N O3
• SMILES: O1[C@@H]([C@H](NC(c2ccccc2)(c2ccccc2)c2ccccc2)CC1)CC(=O)OC
• Title of publication: Crystal Structure of Methyl (2S,3S)-3-Triphenylmethylaminooxolan-2-ylacetate
• Authors of publication: Papaioannou, Dionissios; Francis, George W.; Maartmann-Moe, Knut
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1991
• Journal volume: 45
• Pages of publication: 327 - 328
• a: 10.165 ± 0.001 Å
• b: 12.929 ± 0.001 Å
• c: 16.417 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2157.6 ± 0.4 ų
• Ambient diffraction temperature: 293 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 significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.42
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No