Information card for entry 4306527

Structure parameters

• Common name: Homoleptic Dimer Aniline
• Formula: C108 H82 Cl0 Fe2 N2 S4
• Calculated formula: C108 H82 Cl0 Fe2 N2 S4
• Title of publication: Reactivity of a Sterically Hindered Fe(II) Thiolate Dimer with Amines and Hydrazines
• Authors of publication: Michael J. Zdilla; Atul K. Verma; Sonny C. Lee
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11382 - 11390
• a: 12.276 ± 0.003 Å
• b: 12.791 ± 0.003 Å
• c: 18.173 ± 0.004 Å
• α: 88.04 ± 0.03°
• β: 74.45 ± 0.03°
• γ: 63.27 ± 0.03°
• Cell volume: 2442.9 ± 1.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1013
• Residual factor for significantly intense reflections: 0.0731
• Weighted residual factors for significantly intense reflections: 0.1672
• Weighted residual factors for all reflections included in the refinement: 0.1768
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No