Information card for entry 7206444

Structure parameters

• Formula: C18 H20 S6
• Calculated formula: C16 H18 S6.6
• 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: 18.922 ± 0.007 Å
• b: 17.118 ± 0.009 Å
• c: 6.284 ± 0.003 Å
• α: 90°
• β: 94.23 ± 0.03°
• γ: 90°
• Cell volume: 2029.9 ± 1.6 ų
• Cell temperature: 293.1 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for all reflections included in the refinement: 0.1815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No