Information card for entry 4321890

Structure parameters

• Formula: C61 H71 Cu Fe N2 O P3
• Calculated formula: C48 H66 Cu Fe N2 O2 P2
• Title of publication: Diamond-Shaped Heterometallic Complexes of Iron(II) and Copper(I) Bridged by Cyanide Groups
• Authors of publication: Donald J. Darensbourg; Way-Zen Lee; M. Jason Adams; David L. Larkins; Joseph H. Reibenspies
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 1378 - 1379
• a: 13.3707 ± 0.0009 Å
• b: 13.876 ± 0.002 Å
• c: 15.115 ± 0.002 Å
• α: 67.049 ± 0.009°
• β: 69.073 ± 0.007°
• γ: 80.748 ± 0.009°
• Cell volume: 2411.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1726
• Residual factor for significantly intense reflections: 0.084
• Weighted residual factors for all reflections: 0.3328
• Weighted residual factors for significantly intense reflections: 0.2334
• Goodness-of-fit parameter for all reflections: 0.862
• Goodness-of-fit parameter for significantly intense reflections: 0.856
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No