Information card for entry 7017395

Structure parameters

• Formula: C31 H13 Au F15 P Se
• Calculated formula: C31 H13 Au F15 P Se
• SMILES: [Au](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)[Se]=P(C)(c1ccccc1)c1ccccc1
• Title of publication: New group 11 complexes with metal-selenium bonds of methyldiphenylphosphane selenide: a solid state, solution and theoretical investigation.
• Authors of publication: Pop, Alexandra; Silvestru, Anca; Gimeno, M Concepción; Laguna, Antonio; Kulcsar, Monika; Arca, Massimiliano; Lippolis, Vito; Pintus, Anna
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 46
• Pages of publication: 12479 - 12490
• a: 10.848 ± 0.002 Å
• b: 20.482 ± 0.004 Å
• c: 13.523 ± 0.003 Å
• α: 90°
• β: 97.75 ± 0.03°
• γ: 90°
• Cell volume: 2977.2 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0342
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No