Information card for entry 2243900

Structure parameters

• Chemical name: Poly[[diaqua{μ~6~-2-[bis(carboxylatomethyl)amino]terephthalato}dicobalt(II)] 1.6-hydrate]
• Formula: C12 H14.2 Co2 N O11.6
• Calculated formula: C12 H11 Co2 N O11.6
• Title of publication: Synthesis, crystal structure and magnetic properties of poly[[diaqua{μ~6~-2-[bis(carboxylatomethyl)amino]terephthalato}dicobalt(II)] 1.6-hydrate]
• Authors of publication: Ma, Jie; Zhang, Wen-Zhi; Liu, Yong; Yi, Wen-Tao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 9
• a: 9.0064 ± 0.0009 Å
• b: 9.234 ± 0.0008 Å
• c: 9.8426 ± 0.0009 Å
• α: 93.859 ± 0.003°
• β: 105.571 ± 0.004°
• γ: 99.483 ± 0.005°
• Cell volume: 772.37 ± 0.13 ų
• Cell temperature: 293.15 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0432
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No