Information card for entry 7016210

Structure parameters

• Formula: C60 H50 Au2 P2 S2
• Calculated formula: C60 H50 Au2 P2 S2
• Title of publication: Synthesis, structural characterization, photophysical properties and theoretical analysis of gold(i) thiolate-phosphine complexes.
• Authors of publication: Koshevoy, Igor O.; Smirnova, Ekaterina S.; Haukka, Matti; Laguna, Antonio; Chueca, Jessica Camara; Pakkanen, Tapani A.; Tunik, Sergey P.; Ospino, Isaura; Crespo, Olga
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 28
• Pages of publication: 7412 - 7422
• a: 11.6545 ± 0.0003 Å
• b: 14.2494 ± 0.0004 Å
• c: 17.3478 ± 0.0005 Å
• α: 67.1857 ± 0.0014°
• β: 89.317 ± 0.002°
• γ: 74.5 ± 0.002°
• Cell volume: 2545.3 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.1203
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No