Information card for entry 7231397

Structure parameters

• Chemical name: catena-[(2,4,6-tri(pyridin-2-yl)-1,3,5-triazine)-(μ~5~-hydrogen benzene-1,3,5-tris(4-benzoato))]-zinc(II)-N,N'-dimethylformamide solvate]
• Formula: C48 H35 N7 O7 Zn
• Calculated formula: C48 H35 N7 O7 Zn
• Title of publication: Passing it up the ranks: hierarchical ion-size dependent supramolecular response in 1D coordination polymers
• Authors of publication: Sensharma, Debobroto; Wix, Paul; Kathalikkattil, Amal Cherian; Schmitt, Wolfgang
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 35
• Pages of publication: 5127
• a: 33.908 ± 0.002 Å
• b: 17.5051 ± 0.0013 Å
• c: 15.7559 ± 0.0013 Å
• α: 90°
• β: 115.591 ± 0.005°
• γ: 90°
• Cell volume: 8434.7 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 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: 0.0829
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1664
• Weighted residual factors for all reflections included in the refinement: 0.1826
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No