Information card for entry 4336737

Structure parameters

• Common name: [FeCl2{SO(NMe)Me(NC5H4)}]2*THF
• Chemical name: Di(μ-chloro)-dichloro-bis(N,S-dimethyl-S-2-pyridyl sulfoximine)-diiron(II) tetrahydrofuran solvate
• Formula: C18 H28 Cl4 Fe2 N4 O3 S2
• Calculated formula: C18 H28 Cl4 Fe2 N4 O3 S2
• Title of publication: Synthesis and Structural Characterization of Molybdenum(VI) and Iron(II) Coordination Compounds with S-Alkyl-N-methyl-S-(2-pyridyl)sulfoximines and Catalytic Epoxidation Activity of the Molybdenum Complexes
• Authors of publication: Yvonne Brussaard; Falk Olbrich; Ernst Schaumann
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 13160 - 13166
• a: 8.7334 ± 0.0001 Å
• b: 8.9939 ± 0.0002 Å
• c: 9.3967 ± 0.0002 Å
• α: 96.88 ± 0.001°
• β: 103.671 ± 0.001°
• γ: 104.004 ± 0.001°
• Cell volume: 683.49 ± 0.02 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.0563
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1169
• Weighted residual factors for all reflections included in the refinement: 0.1204
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No