Information card for entry 2010207

Structure parameters

• Formula: C16 H23 N
• Calculated formula: C16 H23 N
• SMILES: N1[C@H]2CCCC[C@H]2C(c2cccc(c12)C)(C)C.N1[C@@H]2CCCC[C@@H]2C(c2cccc(c12)C)(C)C
• Title of publication: Two octahydroacridines
• Authors of publication: Fröhlich, Roland; Grehl, Matthias; Kramm-Glade, Sigrid; Laschat, Sabine
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 11
• Pages of publication: 1798 - 1801
• a: 10.058 ± 0.001 Å
• b: 10.154 ± 0.001 Å
• c: 13.296 ± 0.001 Å
• α: 90°
• β: 94.8 ± 0.01°
• γ: 90°
• Cell volume: 1353.1 ± 0.2 ų
• Cell temperature: 293 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.196
• Goodness-of-fit parameter for significantly intense reflections: 1.175
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No