Information card for entry 7024528

Structure parameters

• Formula: C26 H18 N4
• Calculated formula: C26 H18 N4
• SMILES: c12ccccc1n(c1ccc(cc1)c1ccc(n3c4c(cccc4)nc3)cc1)cn2
• Title of publication: Linear and star-shaped benzimidazolyl derivatives: syntheses, photophysical properties and use as highly efficient electron transport materials in OLEDs.
• Authors of publication: White, Wade; Hudson, Zachary M.; Feng, Xiaodong; Han, Sijin; Lu, Zheng-Hong; Wang, Suning
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 3
• Pages of publication: 892 - 899
• a: 19.548 ± 0.006 Å
• b: 7.058 ± 0.002 Å
• c: 13.842 ± 0.004 Å
• α: 90°
• β: 90.886 ± 0.006°
• γ: 90°
• Cell volume: 1909.5 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.193
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.1019
• Goodness-of-fit parameter for all reflections included in the refinement: 0.738
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No