Information card for entry 2215228

Structure parameters

• Chemical name: Aqua{6,6-dimethyl-2,2'-[o-phenylenebis(nitrilomethylidyne)]diphenolato-<i>κ^4^O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}zinc(II) chloroform solvate
• Formula: C23 H21 Cl3 N2 O3 Zn
• Calculated formula: C23 H21 Cl3 N2 O3 Zn
• SMILES: [Zn]123(Oc4c(cccc4C=[N]2c2ccccc2[N]3=Cc2cccc(c2O1)C)C)[OH2].C(Cl)(Cl)Cl
• Title of publication: Aqua{6,6-dimethyl-2,2'-[<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenolato-<i>{κ</i>^4^O},<i>N</i>,<i>N</i>',<i>O</i>'}zinc(II) chloroform solvate
• Authors of publication: Naser Eltaher Eltayeb; Siang Guan Teoh; Suchada Chantrapromma; Hoong-Kun Fun; Kamarulazizi Ibrahim
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2294 - m2295
• a: 9.0115 ± 0.0001 Å
• b: 10.7771 ± 0.0002 Å
• c: 12.9018 ± 0.0002 Å
• α: 94.338 ± 0.001°
• β: 103.963 ± 0.001°
• γ: 109.851 ± 0.001°
• Cell volume: 1126.55 ± 0.03 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0556
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes