Information card for entry 4103152

Structure parameters

• Formula: C52 H44 Au2 N2 O6 P4
• Calculated formula: C52 H44 Au2 N2 O6 P4
• Title of publication: Guest Escape and Uptake in Nonporous Crystals of a Gold(I) Macrocycle
• Authors of publication: Andrea Deák; Tünde Tunyogi; Zoltán Károly; Szilvia Klébert; Gábor Pálinkás
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 13627 - 13629
• a: 10.1132 ± 0.0018 Å
• b: 12.053 ± 0.002 Å
• c: 19.88 ± 0.004 Å
• α: 98.638 ± 0.008°
• β: 101.042 ± 0.007°
• γ: 90.974 ± 0.008°
• Cell volume: 2348.8 ± 0.7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0843
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No