Information card for entry 2008264

Structure parameters

• Chemical name: (Acetato-O,O')-(acetato-O)-(2,9-dimethyl-1,10-phenanthroline) zinc(ii)
• Formula: C18 H18 N2 O4 Zn
• Calculated formula: C18 H18 N2 O4 Zn
• SMILES: [Zn]12([n]3c(ccc4ccc5ccc([n]1c5c34)C)C)(OC(=O)C)OC(C)=[O]2
• Title of publication: (Acetato-<i>O</i>,<i>O</i>')(acetato-<i>O</i>)(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')zinc(II)
• Authors of publication: Harvey, Miguel; Baggio, Sergio; Baggio, Ricardo; Mombrú, Alvaro W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 3
• Pages of publication: 308 - 310
• a: 14.618 ± 0.003 Å
• b: 9.323 ± 0.002 Å
• c: 25.766 ± 0.005 Å
• α: 90°
• β: 99.31 ± 0.03°
• γ: 90°
• Cell volume: 3465.2 ± 1.3 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: 0.083
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No