Information card for entry 1566969

Structure parameters

• Formula: C38 H24 B Cu2 F8 N7 O6 S2
• Calculated formula: C38 H24 B Cu2 F8 N7 O6 S2
• Title of publication: Robust dicopper(i) μ-boryl complexes supported by a dinucleating naphthyridine-based ligand.
• Authors of publication: Ríos, Pablo; See, Matthew S.; Handford, Rex C.; Teat, Simon J.; Tilley, T. Don
• Journal of publication: Chemical science
• Year of publication: 2022
• Journal volume: 13
• Journal issue: 22
• Pages of publication: 6619 - 6625
• a: 13.3106 ± 0.0001 Å
• b: 22.6847 ± 0.0003 Å
• c: 15.3728 ± 0.0002 Å
• α: 90°
• β: 107.618 ± 0.001°
• γ: 90°
• Cell volume: 4424.05 ± 0.09 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0863
• Residual factor for significantly intense reflections: 0.083
• Weighted residual factors for significantly intense reflections: 0.1948
• Weighted residual factors for all reflections included in the refinement: 0.1964
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No