Information card for entry 4110612

Structure parameters

• Common name: Methyldiphenylsilane
• Chemical name: Methyldiphenyl[2-(phenylazo)phenyl]silane
• Formula: C25 H22 N2 Si
• Calculated formula: C25 H22 N2 Si
• SMILES: [Si](c1ccccc1N=Nc1ccccc1)(C)(c1ccccc1)c1ccccc1
• Title of publication: Reversible Photoswitching of the Coordination Numbers of Silicon in Organosilicon Compounds Bearing a 2-(Phenylazo)phenyl Group
• Authors of publication: Naokazu Kano; Fuminori Komatsu; Masaki Yamamura; Takayuki Kawashima
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 7097 - 7109
• a: 9.94 ± 0.006 Å
• b: 12.243 ± 0.008 Å
• c: 17.692 ± 0.011 Å
• α: 103.468 ± 0.008°
• β: 90.715 ± 0.007°
• γ: 102.807 ± 0.008°
• Cell volume: 2037 ± 2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0393
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No