Information card for entry 7024459

Structure parameters

• Formula: C5 H4 N2 O4 Zn
• Calculated formula: C5 H4 N2 O4 Zn
• Title of publication: The use of ionic liquids in the synthesis of zinc imidazolate frameworks.
• Authors of publication: Martins, Gesley A. V.; Byrne, Peter J.; Allan, Phoebe; Teat, Simon J.; Slawin, Alexandra M. Z.; Li, Yang; Morris, Russell E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 7
• Pages of publication: 1758 - 1762
• a: 8.1997 ± 0.0022 Å
• b: 9.3759 ± 0.0023 Å
• c: 8.424 ± 0.0023 Å
• α: 90 ± 0°
• β: 93.1848 ± 0.007°
• γ: 90 ± 0°
• Cell volume: 646.6 ± 0.3 ų
• Cell temperature: 125.15 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1536
• Weighted residual factors for all reflections included in the refinement: 0.1648
• Goodness-of-fit parameter for all reflections included in the refinement: 1.258
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No