Information card for entry 7104322

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: 7.6863 ± 0.0008 Å
• b: 10.3804 ± 0.0009 Å
• c: 17.944 ± 0.002 Å
• α: 73.353 ± 0.005°
• β: 95.705 ± 0.007°
• γ: 101.578 ± 0.006°
• Cell volume: 1342.4 ± 0.2 ų
• Cell temperature: 93.2 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 significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.1481
• Goodness-of-fit parameter for all reflections included in the refinement: 0.754
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No