Information card for entry 7202537

Structure parameters

• Formula: C20 H15 N
• Calculated formula: C20 H15 N
• SMILES: n1(c2ccccc2c2ccccc12)c1ccc(cc1)C=C
• Title of publication: The synthesis of robust, polymeric hole-transport materials from oligoarylamine substituted styrenes
• Authors of publication: McKeown, Neil B.; Badriya, Samer; Helliwell, Madeleine; Shkunov, Maxim
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2007
• Journal volume: 17
• Journal issue: 20
• Pages of publication: 2088
• a: 16.19 ± 0.04 Å
• b: 7.739 ± 0.01 Å
• c: 23.46 ± 0.03 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2939 ± 9 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: 0.0562
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0919
• Weighted residual factors for all reflections included in the refinement: 0.1001
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No