Information card for entry 4348537

Structure parameters

• Formula: C52 H68 Au2 Cl2 Fe O2 P2 Si2
• Calculated formula: C52 H68 Au2 Cl2 Fe O2 P2 Si2
• SMILES: [c]12([cH]3[c]4([cH]5[cH]1[Fe]16782345[c]2([cH]1[c]6([cH]7[cH]82)O[Si](C(C)C)(C(C)C)C(C)C)[P]([Au]Cl)(c1ccccc1)c1ccccc1)O[Si](C(C)C)(C(C)C)C(C)C)[P]([Au]Cl)(c1ccccc1)c1ccccc1
• Title of publication: Gold(I) Complexes of Ferrocenyl Polyphosphines: Aurophilic Gold Chloride Formation and Phosphine-Concerted Shuttling of a Dinuclear [ClAu···AuCl] Fragment.
• Authors of publication: Rampazzi, Vincent; Roger, Julien; Amardeil, Régine; Penouilh, Marie-José; Richard, Philippe; Fleurat-Lessard, Paul; Hierso, Jean-Cyrille
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 21
• Pages of publication: 10907 - 10921
• a: 18.6943 ± 0.0005 Å
• b: 17.5593 ± 0.0005 Å
• c: 16.7946 ± 0.0005 Å
• α: 90°
• β: 108.199 ± 0.001°
• γ: 90°
• Cell volume: 5237.2 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100.01 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0288
• Residual factor for significantly intense reflections: 0.0193
• Weighted residual factors for significantly intense reflections: 0.0355
• Weighted residual factors for all reflections included in the refinement: 0.0377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No