Information card for entry 7112832

Structure parameters

• Formula: C24 H29 N O2
• Calculated formula: C24 H29 N O2
• SMILES: N(C1CCCCC1)(c1c(C(C)(C)C)cccc1)C(=O)C(=O)c1ccccc1
• Title of publication: Photochemical type II reaction of atropchiral benzoylformamides to point chiral oxazolidin-4-ones. Axial chiral memory leading to enantiomeric resolution of photoproducts.
• Authors of publication: Jesuraj, Josepha L.; Sivaguru, J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 26
• Pages of publication: 4791 - 4793
• a: 12.312 ± 0.003 Å
• b: 8.543 ± 0.002 Å
• c: 19.637 ± 0.005 Å
• α: 90°
• β: 94.405 ± 0.004°
• γ: 90°
• Cell volume: 2059.3 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0693
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1251
• Weighted residual factors for all reflections included in the refinement: 0.1429
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No