Information card for entry 7049446

Structure parameters

• Formula: C32 H24 Br Cu4 F24 N9 O4
• Calculated formula: C32 H24 Br Cu4 F24 N9 O4
• 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: 10.4972 ± 0.0004 Å
• b: 13.6574 ± 0.0005 Å
• c: 16.9248 ± 0.0006 Å
• α: 72.641 ± 0.001°
• β: 81.114 ± 0.001°
• γ: 82.468 ± 0.001°
• Cell volume: 2278.79 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 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: 0.0367
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0515
• Weighted residual factors for all reflections included in the refinement: 0.0548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No