Information card for entry 7055885

Structure parameters

• Formula: C14 H10 N4 O6 Zn
• Calculated formula: C14 H10 N4 O6 Zn
• SMILES: C1(=O)c2ccc(c[n]2[Zn]2(O1)([OH2])([n]1c(C(=O)O2)ccc(c1)C#N)[OH2])C#N
• Title of publication: Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study
• Authors of publication: Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 2
• Pages of publication: 735
• a: 5.019 ± 0.0004 Å
• b: 6.4793 ± 0.0004 Å
• c: 12.6014 ± 0.0006 Å
• α: 91.545 ± 0.004°
• β: 99.276 ± 0.005°
• γ: 110.23 ± 0.006°
• Cell volume: 377.97 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0667
• Weighted residual factors for all reflections included in the refinement: 0.0706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No