Information card for entry 7117085

Structure parameters

• Chemical name: 1,2-bis(indol-2-yl)benzene diethylsilyl complex
• Formula: C26 H24 N2 Si
• Calculated formula: C26 H24 N2 Si
• SMILES: [Si]1(n2c(cc3c2cccc3)c2c(c3n1c1c(cccc1)c3)cccc2)(CC)CC
• Title of publication: Tetracoordinate silicon complexes of 1,2-bis(indol-2-yl)benzene as blue-emitting dyes in the solid state
• Authors of publication: Takayuki Tanaka; Atsuhiro Osuka
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 8123
• a: 14.1331 ± 0.0003 Å
• b: 7.8144 ± 0.0001 Å
• c: 18.4958 ± 0.0003 Å
• α: 90°
• β: 102.186 ± 0.001°
• γ: 90°
• Cell volume: 1996.68 ± 0.06 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1035
• Weighted residual factors for all reflections included in the refinement: 0.1126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No