Information card for entry 7063695

Structure parameters

• Formula: C16 H30 I2 N4 Si
• Calculated formula: C16 H30 I2.0004 N4 Si
• Title of publication: Bis(N-heterocyclic carbene)s incorporating silicon in the ligand backbone
• Authors of publication: Puerta Lombardi, Braulio M.; McCallum, Katia A.; Harrison, Alexander; Louwe, Devon S.; Espejo, Jayar; Bouzidi, Karima; Roesler, Roland
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 16
• Pages of publication: 6554 - 6560
• a: 9.0436 ± 0.0015 Å
• b: 22.182 ± 0.004 Å
• c: 11.772 ± 0.002 Å
• α: 90°
• β: 102.171 ± 0.003°
• γ: 90°
• Cell volume: 2308.4 ± 0.7 ų
• Cell temperature: 173.15 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0835
• Residual factor for significantly intense reflections: 0.0756
• Weighted residual factors for significantly intense reflections: 0.1879
• Weighted residual factors for all reflections included in the refinement: 0.1955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No