Information card for entry 7017029

Structure parameters

• Formula: C48 H46 N6 O2 P2 Rh2 S2
• Calculated formula: C48 H46 N6 O2 P2 Rh2 S2
• SMILES: [Rh]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)(Sc2[n]([Rh]([P](c3ccccc3)(c3ccccc3)c3ccccc3)(Sc3[n]1nc(n3CC)C)C#[O])nc(n2CC)C)C#[O]
• Title of publication: The oxidative conversion of the N,S-bridged complexes [{RhLL'(μ-X)}(2)] to [(RhLL')(3)(μ-X)(2)](+) (X = mt or taz): a comparison with the oxidation of N,N-bridged analogues.
• Authors of publication: Blagg, Robin J.; López-Gómez, María J; Charmant, Jonathan P. H.; Connelly, Neil G.; Cowell, John J.; Haddow, Mairi F.; Hamilton, Alex; Orpen, A. Guy; Riis-Johannessen, Thomas; Saithong, Saowanit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 43
• Pages of publication: 11497 - 11510
• a: 11.37 ± 0.002 Å
• b: 12.483 ± 0.003 Å
• c: 17.364 ± 0.004 Å
• α: 94.83 ± 0.03°
• β: 95.12 ± 0.03°
• γ: 102.3 ± 0.03°
• Cell volume: 2384.8 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0678
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.0869
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No