Information card for entry 4323096

Structure parameters

• Formula: C17 H26 Cl Cu Fe N3 O6
• Calculated formula: C17 H26 Cl Cu Fe N3 O6
• Title of publication: Synthesis, Structure, and Properties of a Tetrametallic Ferrocenecarboxylato-Bridged Copper(II) Complex
• Authors of publication: Ramon Costa; Concepción López; Elies Molins; Enric Espinosa
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 5686 - 5689
• a: 9.92 ± 0.002 Å
• b: 12.925 ± 0.002 Å
• c: 15.768 ± 0.003 Å
• α: 90 ± 0.01°
• β: 93.17 ± 0.01°
• γ: 90 ± 0.01°
• Cell volume: 2018.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.1608
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for all reflections: 0.161
• Weighted residual factors for significantly intense reflections: 0.1377
• Goodness-of-fit parameter for all reflections: 0.932
• Goodness-of-fit parameter for significantly intense reflections: 1.099
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No