Information card for entry 1558560

Structure parameters

• Formula: C111 H119.5 Au2 N5 O
• Calculated formula: C111 H119.5 Au2 N5 O
• Title of publication: N-Heterocyclic Carbenes: A Door Open to Supramolecular Organometallic Chemistry.
• Authors of publication: Ibáñez, Susana; Poyatos, Macarena; Peris, Eduardo
• Journal of publication: Accounts of chemical research
• Year of publication: 2020
• a: 14.4078 ± 0.0004 Å
• b: 24.1255 ± 0.0007 Å
• c: 14.433 ± 0.0004 Å
• α: 90°
• β: 99.165 ± 0.003°
• γ: 90°
• Cell volume: 4952.8 ± 0.2 ų
• Cell temperature: 199.95 ± 0.1 K
• Ambient diffraction temperature: 199.95 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.1058
• Weighted residual factors for all reflections included in the refinement: 0.1092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.227
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No