Information card for entry 7237921

Structure parameters

• Formula: C H Br N O S
• Calculated formula: C3.55556 H3.77778 Br0.444444 N0.444444 O0.444444 S0.444444
• Title of publication: Thiazolothienyl imide-based wide bandgap copolymers for efficient polymer solar cells
• Authors of publication: Shi, Yongqiang; Tang, Yumin; Yang, Kun; Qin, Minchao; Wang, Yang; Sun, Huiliang; Su, Mengyao; Lu, Xinhui; Zhou, Ming; Guo, Xugang
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 36
• Pages of publication: 11142
• a: 4.914 ± 0.004 Å
• b: 10.85 ± 0.008 Å
• c: 18.952 ± 0.012 Å
• α: 74.5 ± 0.08°
• β: 85.4 ± 0.07°
• γ: 84.36 ± 0.09°
• Cell volume: 967.5 ± 1.3 ų
• Cell temperature: 566 ± 2 K
• Ambient diffraction temperature: 566 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.3183
• Residual factor for significantly intense reflections: 0.3135
• Weighted residual factors for significantly intense reflections: 0.749
• Weighted residual factors for all reflections included in the refinement: 0.7616
• Goodness-of-fit parameter for all reflections included in the refinement: 6.293
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No