Information card for entry 7111461

Structure parameters

• Formula: C29.5 H51.5 N6 O2 U
• Calculated formula: C29.5 H48 N6 O2 U
• Title of publication: Bent metal carbene geometries in amido N-heterocyclic carbene complexes
• Authors of publication: Mungur, Shaheed A.; Liddle, Stephen T.; Wilson, Claire; Sarsfield, Mark J.; Arnold, Polly L.
• Journal of publication: Chemical Communications
• Year of publication: 2004
• Journal issue: 23
• Pages of publication: 2738 - 2739
• a: 11.473 ± 0.005 Å
• b: 11.7 ± 0.005 Å
• c: 13.665 ± 0.005 Å
• α: 66.755 ± 0.005°
• β: 80.951 ± 0.005°
• γ: 78.183 ± 0.005°
• Cell volume: 1643.7 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No