Information card for entry 7017925

Structure parameters

• Formula: C21 H20 Au2 Cl2 N3 P S
• Calculated formula: C21 H20 Au2 Cl2 N3 P S
• Title of publication: Aurophilicity in gold(I) thiosemicarbazone clusters.
• Authors of publication: Castiñeiras, Alfonso; Pedrido, Rosa
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 4
• Pages of publication: 1363 - 1372
• a: 9.1233 ± 0.0008 Å
• b: 10.3094 ± 0.0008 Å
• c: 13.3409 ± 0.0011 Å
• α: 100.296 ± 0.004°
• β: 105.008 ± 0.004°
• γ: 96.479 ± 0.004°
• Cell volume: 1175.64 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0354
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0557
• Weighted residual factors for all reflections included in the refinement: 0.0581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No