Information card for entry 8105316

Structure parameters

• Chemical name: catena-poly[bis(μ2-η1:η1-trifluoroacetate-κ2 O:O')- hemi(μ2-2,5-dimethylpyrazine-κ2 N,N')-copper(II)
• Formula: C7 H4 Cu F6 N O4
• Calculated formula: C7 H4 Cu F6 N O4
• Title of publication: Crystal structure of catena-poly[tetrakis(μ2-trifluoroacetato-κ2 O:O′)(μ2-2,5-dimethylpyrazine-κ2 N,N′)dicopper(II)], C7H4CuF6NO4
• Authors of publication: Zhang, Lan; Ren, Yong; Wang, Qiang; Ding, Wu-Xiu; Fei, Wen-Bo
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 4
• Pages of publication: 875 - 877
• a: 8.5122 ± 0.0005 Å
• b: 8.5458 ± 0.0006 Å
• c: 8.8674 ± 0.0006 Å
• α: 75.042 ± 0.003°
• β: 68.601 ± 0.002°
• γ: 89.809 ± 0.003°
• Cell volume: 577.26 ± 0.07 ų
• Cell temperature: 152.41 K
• Ambient diffraction temperature: 152.41 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0295
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.0625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No