Information card for entry 7156404

Structure parameters

• Formula: C28 H34 N2 O Si
• Calculated formula: C28 H34 N2 O Si
• Title of publication: Cobalt-catalyzed cyclization of benzamides with alkynes: a facile route to isoquinolones with hydrogen evolution.
• Authors of publication: Manoharan, Ramasamy; Jeganmohan, Masilamani
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 37
• Pages of publication: 8384 - 8389
• a: 18.218 ± 0.004 Å
• b: 7.7675 ± 0.0018 Å
• c: 18.549 ± 0.004 Å
• α: 90°
• β: 111.106 ± 0.005°
• γ: 90°
• Cell volume: 2448.8 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1056
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.146
• Weighted residual factors for all reflections included in the refinement: 0.1782
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No