Information card for entry 2021303

Structure parameters

• Chemical name: Poly[[tetraaquabis[μ~3~-(2<i>R</i>,2'<i>R</i>)-2,2'-(benzene-1,4-dicarboxamido)dipropionato-κ^5^<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>''':<i>O</i>'']dicadmium(II)] trihydrate]
• Formula: C28 H42 Cd2 N4 O19
• Calculated formula: C28 H42 Cd2 N4 O19
• Title of publication: A new twofold interpenetrated two-dimensional cadmium(II) coordination polymer constructed from 2,2'-(benzene-1,4-dicarboxamido)dipropionate
• Authors of publication: Zhang, Hong-Tao; Wang, Xiao-Long
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 11
• a: 9.2072 ± 0.0008 Å
• b: 15.0256 ± 0.0013 Å
• c: 13.6139 ± 0.0012 Å
• α: 90°
• β: 106.177 ± 0.005°
• γ: 90°
• Cell volume: 1808.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0585
• Weighted residual factors for all reflections included in the refinement: 0.0634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes