Information card for entry 4080615

Structure parameters

• Formula: C34 H10 Ag2 Ir8 O22
• Calculated formula: C34 H10 Ag2 Ir8 O22
• SMILES: [Ir]12([Ir]3456([Ir]781([Ir]123([Ag]247[Ir]3479([Ir]%10%11%12([Ir]%133([Ir]34%10([Ag]47([CH]7C=C[C]12=C[CH]4=7)([C]13=CC=CC=C1)C9=O)(C%12=O)(C%13=O)C#[O])(C%11=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])C#[O])(C5=O)(C8=O)C#[O])(C6=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Semibridging Phenyl Ligands in Iridium‒Copper and Iridium‒Silver Cluster Compounds: Synthesis, Structures, and Bonding
• Authors of publication: Adams, Richard D.; Chen, Mingwei; Elpitiya, Gaya; Yang, Xinzheng; Zhang, Qiang
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 8
• Pages of publication: 2416
• a: 9.1167 ± 0.0014 Å
• b: 14.12 ± 0.002 Å
• c: 17.939 ± 0.003 Å
• α: 85.205 ± 0.003°
• β: 87.131 ± 0.003°
• γ: 80.804 ± 0.003°
• Cell volume: 2270 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1124
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1593
• Weighted residual factors for all reflections included in the refinement: 0.1839
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No