Information card for entry 2230357

Structure parameters

• Chemical name: Chlorido[1-(diphenylphosphanyl)cobaltocenium]gold(I) hexafluoridophosphate
• Formula: C22 H19 Au Cl Co F6 P2
• Calculated formula: C22 H19 Au Cl Co F6 P2
• SMILES: [c]12([cH]3[cH]4[cH]5[cH]1[Co]16782345[cH]2[cH]8[cH]7[cH]6[cH]12)[P]([Au]Cl)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Chlorido[1-(diphenylphosphanyl)cobaltocenium]gold(I) hexafluoridophosphate
• Authors of publication: Wu, Xiang-Hua
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m798
• a: 11.5565 ± 0.0014 Å
• b: 14.8537 ± 0.0014 Å
• c: 27.983 ± 0.003 Å
• α: 90°
• β: 97.577 ± 0.002°
• γ: 90°
• Cell volume: 4761.5 ± 0.9 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 7
• 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: 0.0512
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes