Information card for entry 2209715

Structure parameters

• Chemical name: {μ-2-[1-(N,N-Dimethylamino)ethyl]ferrocene-1,1'-diylbis(diphenylphosphine)- κ^2^P:P'}bis[thiocyanatogold(I)]
• Formula: C40 H37 Au2 Fe N3 P2 S2
• Calculated formula: C40 H37 Au2 Fe N3 P2 S2
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)[c]12[c]3([Fe]4567891([cH]2[cH]4[cH]35)[c]1([cH]6[cH]7[cH]8[cH]91)[P]([Au]SC#N)(c1ccccc1)c1ccccc1)C(N(C)C)C)SC#N
• Title of publication: {μ-2-[1-(<i>N</i>,<i>N</i>-Dimethylamino)ethyl]ferrocene-1,1'-diylbis(diphenylphosphine)-κ^2^<i>P</i>:<i>P</i>'}bis[thiocyanatogold(I)]
• Authors of publication: Sam, Zolisa A.; Elmroth, Sofi K. C.; Roodt, Andreas; Muller, Alfred J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: m1699 - m1701
• a: 9.021 ± 0.005 Å
• b: 13.397 ± 0.005 Å
• c: 16.684 ± 0.005 Å
• α: 89.956 ± 0.005°
• β: 82.946 ± 0.005°
• γ: 74.74 ± 0.005°
• Cell volume: 1929.5 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.147
• Weighted residual factors for all reflections included in the refinement: 0.158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes