Information card for entry 4346291

Structure parameters

• Formula: C41 H41 Au Bi Ir3 N2 O8
• Calculated formula: C41 H41 Au Bi Ir3 N2 O8
• SMILES: [Au]1([Bi]23[Ir]41([Ir]2([Ir]34(C#[O])(C#[O])C#[O])(c1ccccc1)(C#[O])C#[O])(C#[O])(C#[O])C#[O])=C1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: The Addition of Gold and Tin to Bismuth-Triiridium Carbonyl Complexes.
• Authors of publication: Adams, Richard D.; Elpitiya, Gaya
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 16
• Pages of publication: 8042 - 8048
• a: 20.0583 ± 0.0006 Å
• b: 11.5659 ± 0.0003 Å
• c: 20.6645 ± 0.0006 Å
• α: 90°
• β: 101.88 ± 0.001°
• γ: 90°
• Cell volume: 4691.3 ± 0.2 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0442
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.0777
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No