Information card for entry 7017442

Structure parameters

• Formula: C25 H22 Au I5 P2 Se
• Calculated formula: C25 H22 Au I5 P2 Se
• SMILES: [Au]1(I)(I)[Se]=P(C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.I[I-]I
• 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: 21.931 ± 0.002 Å
• b: 10.4353 ± 0.001 Å
• c: 13.727 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3141.5 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0876
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0435
• Weighted residual factors for all reflections included in the refinement: 0.049
• Goodness-of-fit parameter for all reflections included in the refinement: 0.575
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No