Information card for entry 2204390

Structure parameters

• Formula: C37 H38 N2
• Calculated formula: C37 H38 N2
• SMILES: C(N(Cc1c2ccccc2cc2ccccc12)CCC)N(Cc1c2ccccc2cc2ccccc12)CCC
• Title of publication: Bis[<i>N</i>-(9-anthrylmethyl)propylamino]methane
• Authors of publication: Liu, Qing-Xiang; Song, Hai-Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: o1762 - o1763
• a: 20.694 ± 0.007 Å
• b: 12.031 ± 0.004 Å
• c: 23.694 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5899 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.2116
• Residual factor for significantly intense reflections: 0.0612
• Weighted residual factors for significantly intense reflections: 0.1328
• Weighted residual factors for all reflections included in the refinement: 0.1984
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes