Information card for entry 7115803

Structure parameters

• Chemical name: 1,2,3,4-tetrachloro-6, 11-bis((triisopropylsilyl)ethynyl)-5,12-diazatetracene
• Formula: C38 H46 Cl4 N2 Si2
• Calculated formula: C38 H46 Cl4 N2 Si2
• Title of publication: Synthesis, solution-processed thin film transistors and solid solutions of silylethynylated diazatetracenes
• Authors of publication: Xiaomin Xu; Bowen Shan; Sergii Kalytchuk; Minghua Xie; Shuaijun Yang; Danqing Liu; Stephen V. Kershaw; Qian Miao
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 12828
• a: 35.551 ± 0.004 Å
• b: 15.1706 ± 0.0016 Å
• c: 14.9907 ± 0.0016 Å
• α: 90°
• β: 104.265 ± 0.002°
• γ: 90°
• Cell volume: 7835.6 ± 1.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.1967
• Residual factor for significantly intense reflections: 0.0806
• Weighted residual factors for significantly intense reflections: 0.1846
• Weighted residual factors for all reflections included in the refinement: 0.2584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No