Information card for entry 4315030

Structure parameters

• Formula: C20 H20 Ag Mo2 Na O8
• Calculated formula: C20 H20 Ag Mo2 Na O8
• SMILES: [Ag]1234([Mo]5678(C1=O)(C2=O)(C#[O])[cH]1[cH]5[cH]6[cH]7[cH]81)[Mo]1256(C3=O)(C4=O)(C#[O])[cH]3[cH]1[cH]2[cH]5[cH]63.[Na]1[O](C)CC[O]1C
• Title of publication: Heterometallic Chains and Clusters with Gold-Transition Metal Bonds: Synthesis and Interconversion
• Authors of publication: Sabrina Sculfort; Richard Welter; Pierre Braunstein
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2372 - 2382
• a: 15.9681 ± 0.0005 Å
• b: 16.495 ± 0.0006 Å
• c: 11.9423 ± 0.0004 Å
• α: 90°
• β: 129.984 ± 0.002°
• γ: 90°
• Cell volume: 2410.18 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.0831
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No