Information card for entry 4320665

Structure parameters

• Formula: C44 H71 B Cu F4 Fe N O2 P2
• Calculated formula: C44 H71 B Cu F4 Fe N O2 P2
• Title of publication: Synthesis and Characterization of a Monocyanide-Bridged Bimetallic Iron(II) and Copper(I) Complex
• Authors of publication: Donald J. Darensbourg; Way-Zen Lee; Jason C. Yarbrough
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 6533 - 6536
• a: 10.0793 ± 0.0016 Å
• b: 12.0241 ± 0.0018 Å
• c: 19.503 ± 0.003 Å
• α: 93.483 ± 0.005°
• β: 93.217 ± 0.002°
• γ: 102.516 ± 0.003°
• Cell volume: 2297.4 ± 0.6 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1135
• Residual factor for significantly intense reflections: 0.0758
• Weighted residual factors for significantly intense reflections: 0.1946
• Weighted residual factors for all reflections included in the refinement: 0.2299
• Goodness-of-fit parameter for all reflections included in the refinement: 0.741
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No