Information card for entry 1515815

Structure parameters

• Common name: 09188a
• Formula: C24 H24 N2 O7
• Calculated formula: C24 H24 N2 O7
• SMILES: O1[C@@H]2[C@@H](N3C(=O)OC[C@H]3Cc3ccccc3)[C@@H](OC(=O)c3ccc(N(=O)=O)cc3)C[C@H]1CC2
• Title of publication: Stereoselectivity in Oxyallyl-Furan 4+3 Cycloadditions: Control of Intermediate Conformations and Dispersive Stabilisation with Evans' Oxazolidinones.
• Authors of publication: Krenske, Elizabeth H.; Houk, K. N.; Lohse, Andrew G.; Antoline, Jennifer E.; Hsung, Richard P.
• Journal of publication: Chemical science (Royal Society of Chemistry : 2010)
• Year of publication: 2010
• Journal volume: 1
• Journal issue: 3
• Pages of publication: 387 - 392
• a: 6.9199 ± 0.0007 Å
• b: 16.655 ± 0.0016 Å
• c: 18.415 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2122.3 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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 all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0813
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No