Information card for entry 4311697

Structure parameters

• Common name: Zr[ETAM]4 - potassium salt
• Formula: C56 H48 K4 N8 O16 Zr
• Calculated formula: C38.5 H25.5 K2 N4 O12.5 Zr0.5
• Title of publication: Characterization of 2,3-Dihydroxyterephthalamides as M(IV) Chelators1
• Authors of publication: Christine J. Gramer; Kenneth N. Raymond
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 6397 - 6402
• a: 27.576 ± 0.003 Å
• b: 29.345 ± 0.003 Å
• c: 15.266 ± 0.002 Å
• α: 90°
• β: 118.688 ± 0.004°
• γ: 90°
• Cell volume: 10837 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.233
• Residual factor for significantly intense reflections: 0.111
• Weighted residual factors for all reflections: 0.3971
• Weighted residual factors for significantly intense reflections: 0.2969
• Goodness-of-fit parameter for all reflections: 1.016
• Goodness-of-fit parameter for significantly intense reflections: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No