Information card for entry 4307704

Structure parameters

• Formula: C28 H40 Au Cl2 F24 N4 O8 P4 Rh
• Calculated formula: C28 H40 Au Cl2 F24 N4 O8 P4 Rh
• SMILES: [Au]12([Rh](Cl)([P](OCC(F)(F)F)(OCC(F)(F)F)N([P]1(OCC(F)(F)F)OCC(F)(F)F)C)([P](OCC(F)(F)F)(OCC(F)(F)F)N([P]2(OCC(F)(F)F)OCC(F)(F)F)C)(C#[N]C(C)(C)C)C#[N]C(C)(C)C)Cl
• Title of publication: A RhII-AuII Bimetallic Core with a Direct Metal-Metal Bond
• Authors of publication: Arthur J. Esswein; Jillian L. Dempsey; Daniel G. Nocera
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 2362 - 2364
• a: 23.5341 ± 0.0013 Å
• b: 10.8576 ± 0.0006 Å
• c: 22.769 ± 0.0012 Å
• α: 90°
• β: 116.454 ± 0.001°
• γ: 90°
• Cell volume: 5208.8 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0445
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0757
• Weighted residual factors for all reflections included in the refinement: 0.0827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No