Information card for entry 7003308

Structure parameters

• Common name: ((C6H3F2)Xanthdim)Fe2Cl3(Li(thf)3)
• Chemical name: [(C6H3F2)Xanthdim]Fe2Cl3(Li(thf)3)
• Formula: C136 H150 Cl6 F16 Fe4 Li2 N8 O8
• Calculated formula: C136 H150 Cl6 F16 Fe4 Li2 N8 O8
• Title of publication: Dinuclear iron complexes based on parallel β-diiminato binding sites: syntheses, structures and reaction with O2
• Authors of publication: Pilz, Maurice Frederic; Limberg, Christian; Demeshko, Serhiy; Meyer, Franc; Ziemer, Burkhard
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 14
• Pages of publication: 1917 - 1923
• a: 14.284 ± 0.005 Å
• b: 15.375 ± 0.008 Å
• c: 16.471 ± 0.008 Å
• α: 85.24 ± 0.04°
• β: 76.33 ± 0.04°
• γ: 89.89 ± 0.04°
• Cell volume: 3502 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1499
• Residual factor for significantly intense reflections: 0.0874
• Weighted residual factors for significantly intense reflections: 0.2088
• Weighted residual factors for all reflections included in the refinement: 0.2635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No