Information card for entry 1507540

Structure parameters

• Formula: C26 H36 N2 O2
• Calculated formula: C26 H36 N2 O2
• SMILES: O=C(N(C(C)C)C(C)C)c1c(cccc1)c1c(cccc1)C(=O)N(C(C)C)C(C)C
• Title of publication: Conformational Preference and Remote (1,10) Stereocontrol in Biphenyl-2,2‘-dicarboxamides
• Authors of publication: Clayden, Jonathan; Lund, Andrew; Youssef, Latifa H.
• Journal of publication: Organic Letters
• Year of publication: 2001
• Journal volume: 3
• Journal issue: 26
• Pages of publication: 4133
• a: 13.5 Å
• b: 14.009 Å
• c: 25.886 Å
• α: 90°
• β: 94.64°
• γ: 90°
• Cell volume: 4879.56 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0514
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.1203
• Weighted residual factors for all reflections included in the refinement: 0.1287
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No