Information card for entry 2213047

Structure parameters

• Chemical name: 1,3-Bi-9-anthrylpropane
• Formula: C31 H24
• Calculated formula: C31 H24
• SMILES: c1cccc2cc3ccccc3c(c12)CCCc1c2ccccc2cc2ccccc12
• Title of publication: 1,3-Bi-9-anthrylpropane
• Authors of publication: Arslan, Mustafa; Asker, Erol; Masnovi, John; Baker, Ronald J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 4
• Pages of publication: o1800 - o1801
• a: 13.478 ± 0.002 Å
• b: 19.1167 ± 0.0014 Å
• c: 25.2951 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6517.4 ± 1.2 ų
• Cell temperature: 295 ± 2 K
• Number of distinct elements: 2
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes