Information card for entry 2202724

Structure parameters

• Chemical name: 1,2-Dimethyl-1,2-bis(2,3,4-triphenyl-1-naphthyl)disiloxane hexane solvate
• Formula: C64 H60 O Si2
• Calculated formula: C58 H46 O Si2
• SMILES: [SiH](C)(O[SiH](C)c1c(c(c(c2ccccc12)c1ccccc1)c1ccccc1)c1ccccc1)c1c(c(c(c2ccccc12)c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: 1,3-Dimethyl-1,3-bis(2,3,4-triphenyl-1-naphthyl)disiloxane hexane solvate
• Authors of publication: Müller, Thomas; Meyer, Rita; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: o1838 - o1839
• a: 18.716 ± 0.004 Å
• b: 15.533 ± 0.003 Å
• c: 17.685 ± 0.004 Å
• α: 90°
• β: 96.67 ± 0.02°
• γ: 90°
• Cell volume: 5106.5 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.3488
• Residual factor for significantly intense reflections: 0.1341
• Weighted residual factors for significantly intense reflections: 0.2808
• Weighted residual factors for all reflections included in the refinement: 0.3625
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes