Information card for entry 4124307

Structure parameters

• Formula: C26 H26 Si2
• Calculated formula: C26 H26 Si2
• SMILES: c1(ccc2c3c1ccc1ccc(c(c31)cc2)C#C[Si](C)(C)C)C#C[Si](C)(C)C
• Title of publication: Searching the Hearts of Graphene-like Molecules for Simplicity, Sensitivity, and Logic.
• Authors of publication: Sangtarash, Sara; Huang, Cancan; Sadeghi, Hatef; Sorohhov, Gleb; Hauser, Jürg; Wandlowski, Thomas; Hong, Wenjing; Decurtins, Silvio; Liu, Shi-Xia; Lambert, Colin J.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 35
• Pages of publication: 11425 - 11431
• a: 17.0695 ± 0.0003 Å
• b: 6.7893 ± 0.00012 Å
• c: 10.31637 ± 0.00018 Å
• α: 90°
• β: 91.8954 ± 0.0017°
• γ: 90°
• Cell volume: 1194.91 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0513
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.1177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No