Information card for entry 4348837

Structure parameters

• Formula: C41 H41 Au N2 O8 Re2
• Calculated formula: C41 H41 Au N2 O8 Re2
• SMILES: [Au]1([Re]2([Re]1([c]12ccccc1)(C#[O])(C#[O])(C#[O])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: Synthesis and Reactivity of Electronically Unsaturated Dirhenium Carbonyl Compounds Containing Bridging Gold-Carbene Groups.
• Authors of publication: Adams, Richard D.; Dhull, Poonam; Rassolov, Vitaly; Wong, Yuen Onn
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 20
• Pages of publication: 10475 - 10483
• a: 12.5861 ± 0.0007 Å
• b: 20.5884 ± 0.0011 Å
• c: 16.689 ± 0.0009 Å
• α: 90°
• β: 90.488 ± 0.001°
• γ: 90°
• Cell volume: 4324.4 ± 0.4 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: 0.03
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections included in the refinement: 0.0646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No