Information card for entry 7017437

Structure parameters

• Formula: C74 H58 Au2 Cl20 P4 Se2
• Calculated formula: C74 H58 Au2 Cl20 P4 Se2
• SMILES: [Au]12([P](c3cccc4c3c(ccc4)[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[Se][Au]1([P](c3cccc4cccc([P]1(c1ccccc1)c1ccccc1)c34)(c1ccccc1)c1ccccc1)[Se]2.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.[Cl-].C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.[Cl-]
• Title of publication: Halogenation of (phosphine chalcogenide)gold(i) halides; some unexpected products.
• Authors of publication: Taouss, Christina; Jones, Peter G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 44
• Pages of publication: 11687 - 11689
• a: 9.974 ± 0.002 Å
• b: 13.76 ± 0.003 Å
• c: 15.679 ± 0.003 Å
• α: 95.7 ± 0.03°
• β: 97.32 ± 0.03°
• γ: 95.08 ± 0.03°
• Cell volume: 2112.5 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1069
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.1491
• Weighted residual factors for all reflections included in the refinement: 0.1695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No