Information card for entry 1505611

Structure parameters

• Formula: C42 H30 Si2
• Calculated formula: C42 H30 Si2
• SMILES: [Si]1(c2ccccc2c2c1cc1c3c([Si](c1c2)(c1ccccc1)c1ccccc1)cccc3)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis of novel ladder bis-silicon-bridged p-terphenyls.
• Authors of publication: Li, Liangchun; Xiang, Junfeng; Xu, Caihong
• Journal of publication: Organic letters
• Year of publication: 2007
• Journal volume: 9
• Journal issue: 23
• Pages of publication: 4877 - 4879
• a: 8.7417 ± 0.0001 Å
• b: 9.6098 ± 0.0001 Å
• c: 10.645 ± 0.0005 Å
• α: 84.719 ± 0.01°
• β: 79.763 ± 0.01°
• γ: 63.414 ± 0.007°
• Cell volume: 786.88 ± 0.07 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.048
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0956
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No