Information card for entry 4318573

Structure parameters

• Formula: C18 H40 B Cu2 F4 N6 O2
• Calculated formula: C18 H40 B Cu2 F4 N6 O2
• Title of publication: Synthesis and Characterization of Completely Delocalized Mixed-Valent Dicopper Complexes
• Authors of publication: Rajeev Gupta; Zhi Hui Zhang; Douglas Powell; Michael P. Hendrich; A. S. Borovik
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 5100 - 5106
• a: 11.2199 ± 0.0017 Å
• b: 11.7721 ± 0.0017 Å
• c: 20.188 ± 0.003 Å
• α: 97.184 ± 0.003°
• β: 100.535 ± 0.003°
• γ: 90.471 ± 0.003°
• Cell volume: 2599.6 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1458
• Residual factor for significantly intense reflections: 0.0649
• Weighted residual factors for significantly intense reflections: 0.1102
• Weighted residual factors for all reflections included in the refinement: 0.1299
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No