Information card for entry 2235764

Structure parameters

• Chemical name: Bis(acetato-κ<i>O</i>)bis(4,5-dimethylbenzene-1,2-diamine-κ<i>N</i>)zinc
• Formula: C20 H30 N4 O4 Zn
• Calculated formula: C20 H30 N4 O4 Zn
• SMILES: c1(c(cc(c(c1)C)C)N)[NH2][Zn](OC(=O)C)([NH2]c1c(cc(c(c1)C)C)N)OC(=O)C
• Title of publication: Bis(acetato-κ<i>O</i>)bis(4,5-dimethylbenzene-1,2-diamine-κ<i>N</i>)zinc
• Authors of publication: Geiger, David K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: m1040
• a: 18.432 ± 0.003 Å
• b: 4.7414 ± 0.0006 Å
• c: 25.74 ± 0.004 Å
• α: 90°
• β: 92.284 ± 0.004°
• γ: 90°
• Cell volume: 2247.7 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.038
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0931
• Weighted residual factors for all reflections included in the refinement: 0.0944
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes