Information card for entry 7056952

Structure parameters

• Formula: C27 H19 F4 N5 O4 Zn
• Calculated formula: C27 H19 F4 N5 O4 Zn
• SMILES: [Zn]12([n]3c(C(=O)O1)c(F)cc(F)c3)([n]1c(C(=O)O2)c(F)cc(F)c1)([n]1ccccc1)[n]1ccccc1.n1ccccc1
• Title of publication: Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study
• Authors of publication: Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• a: 18.0287 ± 0.0004 Å
• b: 10.3166 ± 0.0002 Å
• c: 14.9805 ± 0.0003 Å
• α: 90°
• β: 106.022 ± 0.001°
• γ: 90°
• Cell volume: 2678.06 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0685
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1038
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No