Information card for entry 2312506

Structure parameters

• Chemical name: <i>catena</i>-Poly[[tetraaquazinc(II)]-μ-5-carboxybenzene-1,3-dicarboxylato-[tetraaquacalcium(II)]-μ-5-carboxybenzene-1,3-dicarboxylato]
• Formula: C18 H24 Ca O20 Zn
• Calculated formula: C18 H24 Ca O20 Zn
• Title of publication: Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid.
• Authors of publication: Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 6
• a: 17.848 ± 0.002 Å
• b: 20.106 ± 0.002 Å
• c: 6.5975 ± 0.0008 Å
• α: 90°
• β: 97.997 ± 0.004°
• γ: 90°
• Cell volume: 2344.5 ± 0.5 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.0554
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1305
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes