Information card for entry 7206442

Structure parameters

• Formula: C14 H6 F2 S4
• Calculated formula: C14 H4 F2.06 S4
• Title of publication: Stabilization of organic field-effect transistors by tert-butyl groups in dibenzotetrathiafulvalene derivatives.
• Authors of publication: Nagakubo, Junki; Ashizawa, Minoru; Kawamoto, Tadashi; Tanioka, Akihiko; Mori, Takehiko
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 32
• Pages of publication: 14370 - 14377
• a: 12.592 ± 0.009 Å
• b: 3.903 ± 0.003 Å
• c: 14.221 ± 0.012 Å
• α: 90°
• β: 110.208 ± 0.018°
• γ: 90°
• Cell volume: 655.9 ± 0.9 ų
• Cell temperature: 293.1 K
• Ambient diffraction temperature: 293.1 K
• Number of distinct elements: 4
• 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: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.1087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No