Information card for entry 4318397

Structure parameters

• Formula: C43.75 H52 Au2 N7 O7.75 P2 S2
• Calculated formula: C43.75 H52 Au2 N7 O7.75 P2 S2
• Title of publication: Supramolecular Gold(I) Thiobarbiturate Chemistry: Combining Aurophilicity and Hydrogen Bonding to Make Polymers, Sheets, and Networks
• Authors of publication: William J. Hunks; Michael C. Jennings; Richard J. Puddephatt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4590 - 4598
• a: 14.262 ± 0.002 Å
• b: 14.7991 ± 0.0018 Å
• c: 15.027 ± 0.003 Å
• α: 60.664 ± 0.007°
• β: 65.33 ± 0.007°
• γ: 69.976 ± 0.007°
• Cell volume: 2474.2 ± 0.7 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1922
• Residual factor for significantly intense reflections: 0.0753
• Weighted residual factors for significantly intense reflections: 0.1415
• Weighted residual factors for all reflections included in the refinement: 0.1748
• Goodness-of-fit parameter for all reflections included in the refinement: 0.912
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No