Information card for entry 1564504

Structure parameters

• Formula: C10 H16 Cl2 N4 Zn
• Calculated formula: C10 H16 Cl2 N4 Zn
• SMILES: [Zn]([n]1[nH]c(C)cc1C)(Cl)(Cl)[n]1c(C)cc([nH]1)C
• Title of publication: Synthesis, structure and biological activity of zinc(II) pincer complexes with 2,4-bis(3,5-dimethyl-1H-pyrazol-1-yl)-6-methoxy-1,3,5-triazine
• Authors of publication: Soliman, Saied M.; Elsilk, Sobhy E.; El-Faham, Ayman
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 508
• Pages of publication: 119627
• a: 15.028 ± 0.009 Å
• b: 8.302 ± 0.005 Å
• c: 24.003 ± 0.015 Å
• α: 90°
• β: 95.71 ± 0.015°
• γ: 90°
• Cell volume: 2980 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0369
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections included in the refinement: 0.0753
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No