Information card for entry 7049169

Structure parameters

• Formula: C85 H66 Au4 P2
• Calculated formula: C85 H66 Au4 P2
• Title of publication: Aurophilicity in action: stepwise formation of dinuclear Au(i) macrocycles with rigid 1,8-dialkynylanthracenes.
• Authors of publication: Niermeier, Philipp; Wickemeyer, Lucas; Neumann, Beate; Stammler, Hans-Georg; Goett-Zink, Lukas; Kottke, Tilman; Mitzel, Norbert W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 13
• Pages of publication: 4109 - 4113
• a: 14.2534 ± 0.0003 Å
• b: 13.31 ± 0.0002 Å
• c: 18.9631 ± 0.0004 Å
• α: 90°
• β: 111.149 ± 0.002°
• γ: 90°
• Cell volume: 3355.23 ± 0.12 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0392
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.0617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No