Information card for entry 7202478

Structure parameters

• Formula: C18 H14 N2 O2 S2
• Calculated formula: C18 H14 N2 O2 S2
• SMILES: c12nc(c3ccc(cc3)OC)sc2nc(s1)c1ccc(cc1)OC
• Title of publication: Synthesis, physical properties and field-effect transistors of novel thiazolothiazole?phenylene co-oligomers
• Authors of publication: Ando, Shinji; Kumaki, Daisuke; Nishida, Jun-ichi; Tada, Hirokazu; Inoue, Youji; Tokito, Shizuo; Yamashita, Yoshiro
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2007
• Journal volume: 17
• Journal issue: 6
• Pages of publication: 553
• a: 3.9826 ± 0.0004 Å
• b: 10.6 ± 0.001 Å
• c: 18.559 ± 0.002 Å
• α: 90°
• β: 91.327 ± 0.005°
• γ: 90°
• Cell volume: 783.27 ± 0.14 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.1601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.832
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No