Information card for entry 7010067

Structure parameters

• Formula: C40 H35 Au Co6 N O13 P
• Calculated formula: C40 H35 Au Co6 N O13 P
• SMILES: [Au]12([Co]34567([Co]89%10%11%121([Co]1%13%14%1523([Co]239([Co]948([Co]512(C%14=O)(C#[O])(C#[O])[C]7%12%1539)(C6=O)(C%10=O)C#[O])(C%11=O)(C%13=O)C#[O])C#[O])C#[O])(C#[O])C#[O])[P](c1ccccc1)(c1ccccc1)c1ccccc1.[N+](CC)(CC)(CC)CC
• Title of publication: Mixed cobalt/gold clusters based on octahedral or prismatic Co6C skeletons
• Authors of publication: Reina, Roser; Riba, Olga; Rossell, Oriol; Seco, Miquel; de Montauzon, Dominique; Pellinghelli, Maria Angela; Tiripicchio, Antonio; Font-Bardía, Mercè; Solans, Xavier
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 23
• Pages of publication: 4464
• a: 9.63 ± 0.006 Å
• b: 22.128 ± 0.007 Å
• c: 21.598 ± 0.008 Å
• α: 90°
• β: 95.44 ± 0.03°
• γ: 90°
• Cell volume: 4582 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.1933
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.14
• Goodness-of-fit parameter for all reflections included in the refinement: 0.84
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No