Information card for entry 7153290

Structure parameters

• Formula: C17 H20 N2 O
• Calculated formula: C17 H20 N2 O
• SMILES: O=C1NCCC[C@@]21Cc1c([nH]c3c1cccc3)C[C@@H]2C.O=C1NCCC[C@]21Cc1c([nH]c3c1cccc3)C[C@H]2C
• Title of publication: Synthesis of spirocyclic carbazole- and acridine-lactams.
• Authors of publication: Würdemann, Martina; Christoffers, Jens
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2010
• Journal volume: 8
• Journal issue: 8
• Pages of publication: 1894 - 1898
• a: 12.1906 ± 0.0008 Å
• b: 23.251 ± 0.002 Å
• c: 9.9292 ± 0.0007 Å
• α: 90°
• β: 97.453 ± 0.008°
• γ: 90°
• Cell volume: 2790.6 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1075
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0418
• Weighted residual factors for all reflections included in the refinement: 0.0513
• Goodness-of-fit parameter for all reflections included in the refinement: 0.52
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No