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Information card for entry 7239966
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Coordinates | 7239966.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (R)-mephenoxalone |
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Chemical name | (R)-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 | 9.7048 ± 0.0007 Å |
b | 5.5085 ± 0.0004 Å |
c | 10.4326 ± 0.0007 Å |
α | 90° |
β | 108.56 ± 0.004° |
γ | 90° |
Cell volume | 528.71 ± 0.07 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.065 |
Residual factor for significantly intense reflections | 0.041 |
Weighted residual factors for significantly intense reflections | 0.0756 |
Weighted residual factors for all reflections included in the refinement | 0.0811 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7239966.html
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