Information card for entry 7233667

Structure parameters

• Formula: C36 H36 N2 O4 S2
• Calculated formula: C36 H36 N2 O4 S2
• Title of publication: Phthalimide-thiophene-based conjugated organic small molecules with high electron mobility
• Authors of publication: Jon-Paul Sun; Arthur D. Hendsbee; Ala a F. Eftaiha; Casper Macaulay; Lesley R. Rutledge; Gregory C. Welch; Ian G. Hill
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2014
• Journal volume: 2
• Pages of publication: 2612 - 2621
• a: 5.021 ± 0.005 Å
• b: 11.022 ± 0.012 Å
• c: 14.579 ± 0.015 Å
• α: 107.556 ± 0.012°
• β: 94.166 ± 0.013°
• γ: 95.76 ± 0.012°
• Cell volume: 760.8 ± 1.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.3388
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1523
• Goodness-of-fit parameter for all reflections included in the refinement: 0.583
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No