Information card for entry 4076008

Structure parameters

• Formula: C30 H22 O6 Re2 Si
• Calculated formula: C30 H22 O6 Re2 Si
• SMILES: [Re]1([H][Re]23456(C#[O])(C#[O])[c]7([Si]1(c1ccccc1)c1ccccc1)[cH]3[cH]4[cH]5[cH]6[cH]27)(C#[O])(C#[O])(C#[O])C#[O].c1ccccc1
• Title of publication: Rhenium Carbonyl Complexes Containing Bridging SiPh3and SiPh2Ligands
• Authors of publication: Adams, Richard D.; Smith, Jack L.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 18
• Pages of publication: 4489
• a: 9.7639 ± 0.0004 Å
• b: 16.9418 ± 0.0007 Å
• c: 17.9854 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2975.1 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0186
• Residual factor for significantly intense reflections: 0.0179
• Weighted residual factors for significantly intense reflections: 0.0445
• Weighted residual factors for all reflections included in the refinement: 0.0448
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No