Information card for entry 2241929

Structure parameters

• Chemical name: Poly[[(μ~2~-acetato-κ^2^<i>O</i>:<i>O</i>')(acetato-κ^2^<i>O</i>,<i>O</i>')(μ~2~-benzene-1,3-diamine-κ^2^<i>N</i>:<i>N</i>')cadmium] hemihydrate]
• Formula: C20 H30 Cd2 N4 O9
• Calculated formula: C20 H30 Cd2 N4 O9
• Title of publication: Two cadmium coordination polymers with bridging acetate and phenylenediamine ligands that exhibit two-dimensional layered structures
• Authors of publication: Geiger, David K.; Parsons, Dylan E.; Pagano, Bracco A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 12
• Pages of publication: 1718 - 1723
• a: 20.777 ± 0.006 Å
• b: 8.2374 ± 0.0018 Å
• c: 15.002 ± 0.004 Å
• α: 90°
• β: 102.583 ± 0.009°
• γ: 90°
• Cell volume: 2505.9 ± 1.1 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: 0.0557
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes