Information card for entry 7123307

Structure parameters

• Formula: C10 H10 Cl N O3
• Calculated formula: C10 H10 Cl N O3
• Title of publication: 4-Hydroxymethyl-Substituted Oxazolidinone Synthesis by Tetraarylphosphonium Salt-Catalyzed Reactions of Glycidols with Isocyanates
• Authors of publication: Toda, Yasunori; Tanaka, Shoya; Gomyou, Shuto; Kikuchi, Ayaka; Suga, Hiroyuki
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 5.985 ± 0.008 Å
• b: 7.965 ± 0.01 Å
• c: 10.657 ± 0.014 Å
• α: 90°
• β: 93.652 ± 0.016°
• γ: 90°
• Cell volume: 507 ± 1.1 ų
• Cell temperature: 88 ± 2 K
• Ambient diffraction temperature: 88 ± 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: 0.046
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No