Information card for entry 7237626

Structure parameters

• Chemical name: 4Br4Ph
• Formula: C46 H26 Br4
• Calculated formula: C46 H26 Br4
• Title of publication: Ambipolar transistors based on chloro-substituted tetraphenylpentacene
• Authors of publication: Sato, Ryonosuke; Eda, Shohei; Sugiyama, Haruki; Uekusa, Hidehiro; Hamura, Toshiyuki; Mori, Takehiko
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 11
• Pages of publication: 3294
• a: 10.3811 ± 0.0003 Å
• b: 13.2135 ± 0.0004 Å
• c: 13.8306 ± 0.0004 Å
• α: 81.924 ± 0.002°
• β: 77.158 ± 0.002°
• γ: 72.986 ± 0.002°
• Cell volume: 1762.94 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0905
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1592
• Weighted residual factors for all reflections included in the refinement: 0.1983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No