Information card for entry 1570771

Structure parameters

• Formula: C19 H26 N2 O3 Si
• Calculated formula: C19 H26 N2 O3 Si
• Title of publication: An un-forgotten classic: the nitro-Mannich reaction between nitrones and silyl nitronates catalysed by B(C₆F₅)₃.
• Authors of publication: Guerzoni, Michael G.; van Ingen, Yara; Babaahmadi, Rasool; Wirth, Thomas; Richards, Emma; Melen, Rebecca L.
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 7
• Pages of publication: 2648 - 2654
• a: 15.3631 ± 0.0005 Å
• b: 11.8472 ± 0.0003 Å
• c: 22.4626 ± 0.0007 Å
• α: 90°
• β: 90.492 ± 0.003°
• γ: 90°
• Cell volume: 4088.3 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0409
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0952
• Weighted residual factors for all reflections included in the refinement: 0.0988
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No