Information card for entry 1508736

Structure parameters

• Formula: C18 H18 N2 O2
• Calculated formula: C18 H18 N2 O2
• SMILES: N1(OC2CON(CC2=CC1)c1ccccc1)c1ccccc1
• Title of publication: Nitroso-dienophile additions to dendralenes: a short synthesis of branched aminosugars.
• Authors of publication: Wang, Ruomeng; Bojase, Gomotsang; Willis, Anthony C.; Paddon-Row, Michael N; Sherburn, Michael S.
• Journal of publication: Organic letters
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 22
• Pages of publication: 5652 - 5655
• a: 15.3122 ± 0.0004 Å
• b: 15.6051 ± 0.0004 Å
• c: 6.1644 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1472.97 ± 0.06 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.0429
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for all reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.0635
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No