Information card for entry 7239965

Structure parameters

• Common name: rac-mephenoxalone
• Chemical name: rac-5-(2-methoxyphenoxymethyl)-2-oxazolidinones
• Formula: C11 H13 N O4
• Calculated formula: C11 H13 N O4
• Title of publication: Chirality-Dependent Supramolecular Synthons based on the 1,3-Oxazolidin-2-one Framework: Chiral Drugs Mephenoxalone, Metaxalone and other 114 examples
• Authors of publication: Bredikhin, Alexander A.; Bredikhina, Zemfira A.; Gubaidullin, Aidar Timergalievich
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 19.5781 ± 0.0011 Å
• b: 9.864 ± 0.0006 Å
• c: 5.5937 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1080.25 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0243
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections included in the refinement: 0.0648
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No