Information card for entry 7132657

Structure parameters

• Formula: C12 H20 Cu F6 N4 O8 S2
• Calculated formula: C12 H20 Cu F6 N4 O8 S2
• Title of publication: Insights into non-covalent interactions in dicopper(II,II) complexes bearing a naphthyridine scaffold: anion-dictated electrochemistry.
• Authors of publication: De Tovar, Jonathan; Philouze, Christian; Thibon-Pourret, Aurore; Belle, Catherine
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 16
• Pages of publication: 2228 - 2231
• a: 10.686 ± 0.002 Å
• b: 14.011 ± 0.003 Å
• c: 8.0619 ± 0.0016 Å
• α: 90°
• β: 110.87 ± 0.03°
• γ: 90°
• Cell volume: 1127.8 ± 0.5 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0325
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0782
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No