Information card for entry 4330133

Structure parameters

• Formula: C138 H108 Au6 N2 O20 P6 Rh10
• Calculated formula: C138 H108 Au6 N2 O20 P6 Rh10
• SMILES: C(#[O])[Rh]123456789%10[Au]%11([P](c%12ccccc%12)(c%12ccccc%12)c%12ccccc%12)[Rh]%12%13%14%15%16%177([C]7%18%192[Rh]2%20%21%22%23%24%254%15([C]4%15%261[Rh]1%27%28%29%305(C#[O])[Au]([P](c5ccccc5)(c5ccccc5)c5ccccc5)[Rh]5%31%224%28(C#[O])(C(=O)[Rh]48%23%15%295(C#[O])([Au]2([P](c2ccccc2)(c2ccccc2)c2ccccc2)[Rh]258%10%19%25(C#[O])([Au]34[P](c3ccccc3)(c3ccccc3)c3ccccc3)C(=O)[Rh]3%167%215(C#[O])([Au]([P](c4ccccc4)(c4ccccc4)c4ccccc4)[Rh]6%17%1883(C#[O])(C%14=O)C2=O)C%13=O)C1=O)C(=O)[Rh]9%11%24%26%30%31(C#[O])([Au]%12%20[P](c1ccccc1)(c1ccccc1)c1ccccc1)C%27=O)C#[O])C#[O].C1CCC(=O)N1C.C1CCC(=O)N1C
• Title of publication: Synthesis, Reactivity, Electrochemical Behavior, and Crystal Structure of a Family of Multivalent Metal Carbido-Carbonyl Clusters Based on the Rh10(C)2Au4-6Framework
• Authors of publication: Laura Cherchi; Alessandro Fumagalli; Serena Fedi; Piero Zanello; Fabrizia Fabrizi De Biani; Franco Laschi; Luigi Garlaschelli; Piero Macchi; Angelo Sironi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 9171 - 9180
• a: 14.703 ± 0.0018 Å
• b: 15.064 ± 0.0019 Å
• c: 15.283 ± 0.0019 Å
• α: 90.924 ± 0.0018°
• β: 97.955 ± 0.0018°
• γ: 100.375 ± 0.0018°
• Cell volume: 3294.7 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0346
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No