Information card for entry 2221840

Structure parameters

• Chemical name: 8-Hydroxy-2-methylquinolinium dichlorido(2-methylquinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)zincate(II) methanol solvate
• Formula: C21 H22 Cl2 N2 O3 Zn
• Calculated formula: C21 H22 Cl2 N2 O3 Zn
• SMILES: [Zn]1(Cl)(Cl)Oc2cccc3c2[n]1c(cc3)C.Oc1cccc2c1[nH+]c(cc2)C.OC
• Title of publication: 8-Hydroxy-2-methylquinolinium dichlorido(2-methylquinolin-8-olato-κ^2^<i>N</i>,<i>O</i>)zincate(II) methanol solvate
• Authors of publication: Sattarzadeh, Elham; Mohammadnezhad, Gholamhossein; Amini, Mostafa M.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m553
• a: 10.0717 ± 0.0002 Å
• b: 13.7886 ± 0.0003 Å
• c: 15.4828 ± 0.0003 Å
• α: 90°
• β: 105.48 ± 0.01°
• γ: 90°
• Cell volume: 2072.17 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.108
• 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: Yes