Information card for entry 2010962

Structure parameters

• Formula: C26 H34 O6
• Calculated formula: C26 H34 O6
• SMILES: O[C@H]1[C@H]([C@H](OCc2ccc(OC)cc2)[C@@H](OCc2ccc(OC)cc2)CC1)[C@]1(O[C@@H]1C)C
• Title of publication: (1<i>R</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>)-2-[(2<i>R</i>,3<i>S</i>)-2,3-Dimethyloxiran-2-yl]-3,4-bis(4-methoxybenzyloxy)cyclohexanol
• Authors of publication: Kani, Yoshiyuki; Ohba, Shigeru; Amano, Seiji; Ogawa, Noriko; Ohtsuka, Masami; Chida, Noritaka
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 5
• Pages of publication: e222 - e222
• a: 18.06 ± 0.003 Å
• b: 23.477 ± 0.003 Å
• c: 5.736 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2432 ± 1 ų
• Cell temperature: 296 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 significantly intense reflections: 0.073
• Weighted residual factors for all reflections included in the refinement: 0.221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.92
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes