Information card for entry 7059186

Structure parameters

• Formula: C25 H16 O S
• Calculated formula: C25 H16 O S
• Title of publication: Functionalization of commercial pigment Hostasol Red GG for incorporation into organic thin-film transistors
• Authors of publication: Melville, Owen A.; Grant, Trevor M.; Rice, Nicole A.; Wang, Bowen; Josse, Pierre; Lessard, Benoît H.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 3
• Pages of publication: 845 - 851
• a: 5.25 ± 0.006 Å
• b: 15.787 ± 0.019 Å
• c: 20.19 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1673 ± 3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1696
• Residual factor for significantly intense reflections: 0.0807
• Weighted residual factors for significantly intense reflections: 0.1747
• Weighted residual factors for all reflections included in the refinement: 0.237
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No