Information card for entry 7713685

Structure parameters

• Formula: C27 H20 F6 Ga N4 O4 P
• Calculated formula: C27 H20 F6 Ga N4 O4 P
• Title of publication: Synthesis, characterisation and antibacterial activity of novel Ga(III) polypyridyl catecholate complexes
• Authors of publication: More O'Ferrall, Lewis; Piatek, Magdalena; Twamley, Brendan; Kavanagh, Kevin; O'Connor, Christine; Griffith, Darren Martin
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 24.4395 ± 0.0007 Å
• b: 8.6262 ± 0.0003 Å
• c: 26.9096 ± 0.0007 Å
• α: 90°
• β: 110.515 ± 0.0014°
• γ: 90°
• Cell volume: 5313.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0845
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.1797
• Weighted residual factors for all reflections included in the refinement: 0.1916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No