Information card for entry 4063901

Structure parameters

• Chemical name: dicarbonyl(cyclopentadienyl)(dimethyl(phenyl)stibane)iron(II) tetrafluoroborate
• Formula: C15 H16 B F4 Fe O2 Sb
• Calculated formula: C15 H16 B F4 Fe O2 Sb
• SMILES: [Sb]([Fe]1234([cH]5[cH]1[cH]2[cH]3[cH]45)(C#[O])C#[O])(C)(C)c1ccccc1.[B](F)(F)(F)[F-]
• Title of publication: Hybrid Dibismuthines and Distibines: Preparation and Properties of Antimony and Bismuth Oxygen, Sulfur, and Nitrogen Donor Ligands
• Authors of publication: Benjamin, Sophie L.; Karagiannidis, Louise; Levason, William; Reid, Gillian; Rogers, Michael C.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 4
• Pages of publication: 895
• a: 6.9012 ± 0.001 Å
• b: 13.6533 ± 0.0015 Å
• c: 18.753 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1767 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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: 0.034
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0735
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No