Information card for entry 4102178

Structure parameters

• Formula: C34 H74 I N4 O Si5 Y
• Calculated formula: C34 H74 I N4 O Si5 Y
• SMILES: I[Y](N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)OC(C)(C)C[N+]1=C([Si](C)(C)C)N(CC1)c1c(cccc1C(C)C)C(C)C
• Title of publication: Addition-Elimination Reactions across the M-C Bond of Metal N-Heterocyclic Carbenes
• Authors of publication: Zoë R. Turner; Ronan Bellabarba; Robert P. Tooze; Polly L. Arnold
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 4050 - 4051
• a: 9.6227 ± 0.0008 Å
• b: 16.3315 ± 0.0013 Å
• c: 16.4128 ± 0.0014 Å
• α: 106.924 ± 0.004°
• β: 94.311 ± 0.004°
• γ: 106.275 ± 0.004°
• Cell volume: 2334 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0395
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No