Information card for entry 4313421

Structure parameters

• Common name: TypeIII-Fc4NCuII
• Formula: C36 H50 Cl2 Cu Fe2 N6 O8
• Calculated formula: C36 H50 Cl2 Cu Fe2 N6 O8
• Title of publication: Thermically and Electrochemically Induced Isomerization of a (Bis(ferrocene)-cyclam)copper(II) Complex
• Authors of publication: Christophe Bucher; Jean-Claude Moutet; Jacques Pécaut; Guy Royal; Eric Saint-Aman; Fabrice Thomas; Stéphane Torelli; Mihaela Ungureanu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2242 - 2252
• a: 10.6084 ± 0.0013 Å
• b: 12.0962 ± 0.0014 Å
• c: 16.0326 ± 0.0019 Å
• α: 83.073 ± 0.002°
• β: 81.848 ± 0.002°
• γ: 75.83 ± 0.002°
• Cell volume: 1966.6 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0556
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No