Information card for entry 4108097

Structure parameters

• Formula: C24 H12 N O2 S4
• Calculated formula: C24 H12 N O2 S4
• Title of publication: n-Channel Polymers by Design: Optimizing the Interplay of Solubilizing Substituents, Crystal Packing, and Field-Effect Transistor Characteristics in Polymeric Bithiophene-Imide Semiconductors
• Authors of publication: Joseph A. Letizia; Michael R. Salata; Caitlin M. Tribout; Antonio Facchetti; Mark A. Ratner; Tobin J. Marks
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 9679 - 9694
• a: 40.173 ± 0.002 Å
• b: 40.173 ± 0.002 Å
• c: 7.1602 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 10007.5 ± 1.1 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0856
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1971
• Weighted residual factors for all reflections included in the refinement: 0.2132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No