Information card for entry 7713684

Structure parameters

• Formula: C32.5 H24.5 F6 Ga N4 O4.75 P
• Calculated formula: C32.5 H24.5 F6 Ga N4 O4.75 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: 15.8706 ± 0.0009 Å
• b: 8.8591 ± 0.0005 Å
• c: 23.0866 ± 0.0012 Å
• α: 90°
• β: 109.003 ± 0.001°
• γ: 90°
• Cell volume: 3069.1 ± 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: 0.0876
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.1465
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No