Information card for entry 2220909

Structure parameters

• Chemical name: {6,6'-Dimethoxy-2,2'-[<i>o</i>- phenylenebis(nitrilomethylidyne)]diphenolato}cobalt(II) dichloromethane disolvate
• Formula: C24 H22 Cl4 Co N2 O4
• Calculated formula: C24 H22 Cl4 Co N2 O4
• SMILES: [Co]123Oc4c(C=[N]3c3c([N]2=Cc2cccc(OC)c2O1)cccc3)cccc4OC.ClCCl.ClCCl
• Title of publication: {6,6'-Dimethoxy-2,2'-[<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenolato}cobalt(II) dichloromethane disolvate
• Authors of publication: Nabei, Atsuhiro; Kuroda-Sowa, Takayoshi; Okubo, Takashi; Maekawa, Masahiko; Munakata, Megumu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m188 - m189
• a: 13.309 ± 0.006 Å
• b: 14.088 ± 0.006 Å
• c: 14.101 ± 0.006 Å
• α: 90°
• β: 109.676 ± 0.006°
• γ: 90°
• Cell volume: 2489.5 ± 1.9 ų
• Cell temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for all reflections included in the refinement: 0.0886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes