Information card for entry 1565460

Structure parameters

• Formula: C25.75 H23.5 Au Cl1.5 N3 S
• Calculated formula: C25.75 H23.5 Au Cl1.5 N3 S
• Title of publication: Pyrrole thioamide complexes of the d8 metals platinum(II), palladium(II) and gold(III)
• Authors of publication: Tang, Haiming; Saunders, Graham C.; Ma, Xiaochuan; Henderson, William
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 502
• Pages of publication: 119282
• a: 10.3271 ± 0.0005 Å
• b: 12.0211 ± 0.0006 Å
• c: 12.2148 ± 0.0005 Å
• α: 118.107 ± 0.005°
• β: 98.606 ± 0.004°
• γ: 105.272 ± 0.004°
• Cell volume: 1221.73 ± 0.14 ų
• Cell temperature: 111 ± 15 K
• Ambient diffraction temperature: 111 ± 15 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: 0.0484
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.121
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0369
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No