Information card for entry 1568687

Structure parameters

• Formula: C27.5 H35 N O2 Si
• Calculated formula: C27.5 H35 N O2 Si
• Title of publication: Palladium-catalyzed synthesis of 4-sila-4<i>H</i>-benzo[<i>d</i>][1,3]oxazines by intramolecular Hiyama coupling.
• Authors of publication: Lee, Donghyeon; Shintani, Ryo
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 15
• Pages of publication: 4114 - 4119
• a: 14.2116 ± 0.0014 Å
• b: 19.3311 ± 0.0019 Å
• c: 9.9202 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2725.3 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.1481
• Weighted residual factors for all reflections included in the refinement: 0.1602
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No