Information card for entry 7117426

Structure parameters

• Formula: C24 H22 O Si
• Calculated formula: C24 H22 O Si
• SMILES: [Si]1(c2cccc3cccc(c23)C\1=C(C)\C#Cc1ccc(OC)cc1)(C)C
• Title of publication: Rhodium-catalyzed intramolecular alkynylsilylation of alkynes
• Authors of publication: Ryo Shintani; Hiroki Kurata; Kyoko Nozaki
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 11378
• a: 8.624 ± 0.004 Å
• b: 15.417 ± 0.007 Å
• c: 7.309 ± 0.003 Å
• α: 90°
• β: 104.681 ± 0.007°
• γ: 90°
• Cell volume: 940.1 ± 0.7 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No