Information card for entry 7049447

Structure parameters

• Formula: C14 Cu2 F18 N4 O2
• Calculated formula: C14 Cu2 F18 N4 O2
• Title of publication: Carbonyl complexes of copper(i) stabilized by bridging fluorinated pyrazolates and halide ions.
• Authors of publication: Parasar, Devaborniny; Jayaratna, Naleen B.; Muñoz-Castro, Alvaro; Conway, Allison E.; Mykhailiuk, Pavel K.; Dias, H. V. Rasika
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 19
• Pages of publication: 6358 - 6371
• a: 13.702 ± 0.004 Å
• b: 18.154 ± 0.005 Å
• c: 8.944 ± 0.002 Å
• α: 90°
• β: 101.012 ± 0.004°
• γ: 90°
• Cell volume: 2183.8 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.01 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections included in the refinement: 0.0676
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No