Information card for entry 4306521

Structure parameters

• Formula: C40 H66 Cu F6 N4 S4
• Calculated formula: C40 H66 Cu F6 N4 S4
• Title of publication: Ferromagnetic Interactions in Heterobimetallic Chains Formed through the Secondary Coordination of Dithiolene Complexes
• Authors of publication: Olivier Jeannin; Rodolphe Clérac; Thomas Cauchy; Marc Fourmigué
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 10656 - 10661
• a: 15.2546 ± 0.0015 Å
• b: 22.2558 ± 0.0016 Å
• c: 15.7617 ± 0.0012 Å
• α: 90°
• β: 112.426 ± 0.01°
• γ: 90°
• Cell volume: 4946.5 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1868
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0986
• Goodness-of-fit parameter for all reflections included in the refinement: 0.727
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No