Information card for entry 7059613

Structure parameters

• Common name: tc-tc
• Chemical name: tcaz-tcaz
• Formula: C40 H48 N2
• Calculated formula: C40 H48 N2
• Title of publication: tert-Butyl-substituted bicarbazole as a bipolar host material for efficient green and yellow PhOLEDs
• Authors of publication: Zhou, Dandan; Zhang, Bingqian; Yu, Zhenyi; Liao, Qing; Fu, Hongbing
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 25
• Pages of publication: 10472 - 10478
• a: 21.042 ± 0.0009 Å
• b: 15.9328 ± 0.0007 Å
• c: 10.1429 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3400.5 ± 0.3 ų
• Cell temperature: 128.15 K
• Ambient diffraction temperature: 128.15 K
• Number of distinct elements: 3
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0673
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No