Information card for entry 2239109

Structure parameters

• Common name: [Cp*RuCl3RuCp*][PF6]
• Chemical name: Tri-μ-chlorido-bis[(η^5^-pentamethylcyclopentadienyl)rhodium(III)] hexafluoridophosphate
• Formula: C20 H30 Cl3 F6 P Rh2
• Calculated formula: C20 H30 Cl3 F6 P Rh2
• SMILES: [Rh]123456([c]7([c]1([c]2([c]3([c]47C)C)C)C)C)[Cl][Rh]1234([Cl]5)([Cl]6)[c]5([c]1([c]2([c]3([c]45C)C)C)C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Tri-μ-chlorido-bis[(η^5^-pentamethylcyclopentadienyl)rhodium(III)] hexafluoridophosphate from synchrotron radiation
• Authors of publication: Ezzedinloo, Lida; Shrestha, Sumi; Bhadbhade, Mohan; Colbran, Stephen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 1
• Pages of publication: m14 - m15
• a: 8.097 ± 0.0016 Å
• b: 12.604 ± 0.003 Å
• c: 14.441 ± 0.003 Å
• α: 64.28 ± 0.03°
• β: 82.42 ± 0.03°
• γ: 86.7 ± 0.03°
• Cell volume: 1316.2 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0254
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0593
• Weighted residual factors for all reflections included in the refinement: 0.0595
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes