Information card for entry 2229802

Structure parameters

• Chemical name: Dicarbonyldichloridobis(trimethylphosphane)iron(II)‒ carbonyldichloridotris(trimethylphosphane)iron(II)‒tetrahydrofuran (1/1/2)
• Formula: C26 H61 Cl4 Fe2 O5 P5
• Calculated formula: C26 H61 Cl4 Fe2 O5 P5
• Title of publication: Dicarbonyldichloridobis(trimethylphosphane)iron(II)‒carbonyldichloridotris(trimethylphosphane)iron(II)‒tetrahydrofuran (1/1/2)
• Authors of publication: Rath, Nigam P.; Stouffer, Meghan; Janssen, Matthew K.; Bleeke, John R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 4
• Pages of publication: m462
• a: 10.8391 ± 0.0009 Å
• b: 16.967 ± 0.0012 Å
• c: 22.2871 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4098.8 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.05
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes