Information card for entry 4003572

Structure parameters

• Common name: S-DNTT-6
• Formula: C34 H36 S2
• Calculated formula: C34 H36 S2
• Title of publication: Solution-Processable Organic Semiconductors Featuring S-Shaped Dinaphthothienothiophene (S-DNTT): Effects of Alkyl Chain Length on Self-Organization and Carrier Transport Properties
• Authors of publication: Yamaguchi, Yuji; Kojiguchi, Yuka; Kawata, So; Mori, Tatsuya; Okamoto, Kazuo; Tsutsui, Masanori; Koganezawa, Tomoyuki; Katagiri, Hiroshi; Yasuda, Takuma
• Journal of publication: Chemistry of Materials
• Year of publication: 2020
• a: 7.2092 ± 0.0004 Å
• b: 8.5332 ± 0.0008 Å
• c: 11.1656 ± 0.0014 Å
• α: 82.946 ± 0.009°
• β: 77.081 ± 0.008°
• γ: 80.005 ± 0.006°
• Cell volume: 656.8 ± 0.11 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0703
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.1551
• Weighted residual factors for all reflections included in the refinement: 0.1613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No