Information card for entry 2213246

Structure parameters

• Chemical name: Bis(2-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')bis[methyl N-(3-pyridyl)carbamato-κ<i>N</i>]zinc(II)
• Formula: C28 H24 Cl2 N4 O8 Zn
• Calculated formula: C28 H24 Cl2 N4 O8 Zn
• SMILES: c1c(NC(=O)OC)ccc[n]1[Zn]12([n]3cc(NC(=O)OC)ccc3)(OC(=[O]1)c1c(cccc1)Cl)OC(=[O]2)c1c(cccc1)Cl
• Title of publication: Bis(2-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')bis[methyl <i>N</i>-(3-pyridyl)carbamato-κ<i>N</i>]zinc(II)
• Authors of publication: Maroszová, Jaroslava; Findoráková, Lenka; Györyvá, Katarína; Moncol, Jan; Melník, Milan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1520 - m1520
• a: 15.444 ± 0.003 Å
• b: 13.65 ± 0.003 Å
• c: 13.627 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2872.7 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0894
• Weighted residual factors for all reflections included in the refinement: 0.0964
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes