Information card for entry 7104325

Structure parameters

• Formula: C36 H18 F6 O2 S2
• Calculated formula: C36 H18 F6 O2 S2
• SMILES: s1c(c2ccc(C(F)(F)F)cc2)ccc1c1ccc2C(=O)c3cc(ccc3C(=O)c2c1)c1sc(cc1)c1ccc(cc1)C(F)(F)F
• Title of publication: Anthraquinone derivatives affording n-type organic thin film transistors.
• Authors of publication: Mamada, Masashi; Nishida, Jun-Ichi; Tokito, Shizuo; Yamashita, Yoshiro
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 16
• Pages of publication: 2177 - 2179
• a: 7.7033 ± 0.0015 Å
• b: 10.4109 ± 0.0019 Å
• c: 17.98 ± 0.003 Å
• α: 73.309 ± 0.004°
• β: 84.213 ± 0.005°
• γ: 78.391 ± 0.005°
• Cell volume: 1351.5 ± 0.4 ų
• Cell temperature: 93.1 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 significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.2558
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No