Information card for entry 7133877

Structure parameters

• Formula: C31 H45 N3 O2 Si
• Calculated formula: C31 H45 N3 O2 Si
• Title of publication: Reversible CO₂ insertion into the silicon-nitrogen σ-bond of an N-heterocyclic iminosilane.
• Authors of publication: Wang, Jingyan; Hwang, Gi Byoung; Knapp, Caroline E.; Wilson, Daniel W. N.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 89
• Pages of publication: 13051 - 13054
• a: 27.23555 ± 0.00007 Å
• b: 27.23555 ± 0.00007 Å
• c: 17.39351 ± 0.00008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12902.1 ± 0.08 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0463
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.115
• Weighted residual factors for all reflections included in the refinement: 0.1176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No