Information card for entry 4125035

Structure parameters

• Chemical name: bis(triphenylphosphoranylidene)ammonium copper dicyanoaurate ethanolate
• Formula: C50 H42 Au5 Cu2 N11 O2 P2
• Calculated formula: C50 H42 Au5 Cu2 N11 O2 P2
• Title of publication: Dicyanometallates as Model Extended Frameworks.
• Authors of publication: Hill, Joshua A.; Thompson, Amber L.; Goodwin, Andrew L.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 18
• Pages of publication: 5886 - 5896
• a: 27.9505 ± 0.0006 Å
• b: 15.0898 ± 0.0004 Å
• c: 13.4803 ± 0.0003 Å
• α: 90°
• β: 96.629 ± 0.002°
• γ: 90°
• Cell volume: 5647.5 ± 0.2 ų
• Cell temperature: 30 K
• Ambient diffraction temperature: 30 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for all reflections: 0.0898
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9915
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No