Information card for entry 7047234

Structure parameters

• Chemical name: Tris[5-(pentafluorophenyl)dipyrrin]gallium(III)
• Formula: C45 H18 F15 Ga N6
• Calculated formula: C45 H18 F15 Ga N6
• Title of publication: Pre-/Post-functionalization in Dipyrrin Metal Complexes ‒ Antitumor and Antibacterial Activity of their Glycosylated Derivatives
• Authors of publication: Wiehe, Arno; Gutsche, Claudia Simone; Gräfe, Susanna; Gitter, Burkhard; Flanagan, Keith; Senge, Mathias; Kulak, Nora
• Journal of publication: Dalton Transactions
• Year of publication: 2018
• a: 25.765 ± 0.0008 Å
• b: 8.8371 ± 0.0003 Å
• c: 35.7783 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8146.3 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0679
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1127
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No