Information card for entry 2213775

Structure parameters

• Chemical name: 3,5-Bis(trimethylsilyl)triphenyleno[1,12-bcd]thiophene
• Formula: C24 H26 S Si2
• Calculated formula: C24 H26 S Si2
• SMILES: s1c2c3c4c(c5c(cccc5)c3ccc2[Si](C)(C)C)ccc([Si](C)(C)C)c14
• Title of publication: 3,5-Bis(trimethylsilyl)triphenyleno[1,12-<i>bcd</i>]thiophene
• Authors of publication: Masaichi Saito; Tomoharu Tanikawa; Tomoyuki Tajima
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: o2923 - o2923
• a: 7.023 ± 0.0003 Å
• b: 14.4933 ± 0.0007 Å
• c: 20.8358 ± 0.001 Å
• α: 90°
• β: 92.707 ± 0.001°
• γ: 90°
• Cell volume: 2118.44 ± 0.17 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes