Information card for entry 7023200

Structure parameters

• Chemical name: Bis{η^5^-[bis(2-methoxy-4-(3-propenyl)(dichloro(η^6^- (4-(2-propyl)toluene)ruthenium(II)phosphino]cylopentadienyl} iron(II)
• Formula: C70 H80 Cl4 Fe O8 P2 Ru2
• Calculated formula: C70 H80 Cl4 Fe O8 P2 Ru2
• Title of publication: Synthesis, transition metal chemistry and catalytic reactions of ferrocenylbis(phosphonite), [Fe{C5H4P(OC6H3(OMe-o)(C3H5-p))2}2].
• Authors of publication: Rao, Sowmya; Mague, Joel T.; Balakrishna, Maravanji S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 32
• Pages of publication: 11695 - 11708
• a: 13.32 ± 0.003 Å
• b: 14.572 ± 0.003 Å
• c: 19.016 ± 0.004 Å
• α: 78.967 ± 0.003°
• β: 86.074 ± 0.003°
• γ: 84.913 ± 0.003°
• Cell volume: 3603.5 ± 1.3 ų
• Cell temperature: 195 ± 2 K
• Ambient diffraction temperature: 195 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1048
• Residual factor for significantly intense reflections: 0.0614
• Weighted residual factors for significantly intense reflections: 0.1527
• Weighted residual factors for all reflections included in the refinement: 0.1801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No