Information card for entry 4082201

Structure parameters

• Formula: C44 H30 Au2 O8 P2 Re2
• Calculated formula: C44 H30 Au2 O8 P2 Re2
• SMILES: c1(ccccc1)[P]([Au]1[Re]2(C#[O])(C#[O])(C#[O])(C#[O])[Au]([P](c3ccccc3)(c3ccccc3)c3ccccc3)[Re]12(C#[O])(C#[O])(C#[O])C#[O])(c1ccccc1)c1ccccc1
• Title of publication: Studies of the Structures and Bonding of Gold-Bridged Dirhenium Carbonyl Cluster Complexes
• Authors of publication: Adams, Richard D.; Wong, Yuen Onn; Zhang, Qiang
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 24
• Pages of publication: 7540
• a: 9.2034 ± 0.0002 Å
• b: 14.6713 ± 0.0002 Å
• c: 16.482 ± 0.0003 Å
• α: 90°
• β: 101.35°
• γ: 90°
• Cell volume: 2181.97 ± 0.07 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0223
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0434
• Weighted residual factors for all reflections included in the refinement: 0.0449
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No