Information card for entry 7046482

Structure parameters

• Formula: C77 H122 Ag2 Cl4 N12 O6 Se5
• Calculated formula: C77 H122 Ag2 Cl4 N12 O6 Se5
• Title of publication: Coinage metal complexes of selenoureas derived from N-heterocyclic carbenes.
• Authors of publication: Nahra, Fady; Van Hecke, Kristof; Kennedy, Alan R.; Nelson, David J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 31
• Pages of publication: 10671 - 10684
• a: 16.3612 ± 0.0002 Å
• b: 30.0343 ± 0.0004 Å
• c: 18.7111 ± 0.0003 Å
• α: 90°
• β: 107.848 ± 0.002°
• γ: 90°
• Cell volume: 8752.1 ± 0.2 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0841
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1759
• Weighted residual factors for all reflections included in the refinement: 0.196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No