Information card for entry 7060421

Structure parameters

• Formula: C27 H34 S3 Si
• Calculated formula: C27 H34 S3 Si
• Title of publication: A thiol‒ene click reaction with preservation of the Si‒H bond: a new approach for the synthesis of functional organosilicon compounds
• Authors of publication: Anisimov, Anton A.; Temnikov, Maxim N.; Krizhanovskiy, Ilya; Timoshina, Ekaterina I.; Milenin, Sergey A.; Peregudov, Alexander S.; Dolgushin, Fedor M.; Muzafarov, Aziz M.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 13
• Pages of publication: 5764 - 5769
• a: 14.6919 ± 0.0005 Å
• b: 14.6919 ± 0.0005 Å
• c: 6.9649 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1301.97 ± 0.08 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0838
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No