Information card for entry 7024460

Structure parameters

• Common name: Compound 2
• Formula: C5 H6 N2 O2 Zn
• Calculated formula: C5 H6 N2 O2 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: 10.987 ± 0.004 Å
• b: 7.679 ± 0.002 Å
• c: 8.6446 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 729.3 ± 0.4 ų
• Cell temperature: 150 ± 0.2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 46
• Hermann-Mauguin space group symbol: I m a 2
• Hall space group symbol: I 2 -2a
• Residual factor for all reflections: 0.0538
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1473
• Weighted residual factors for all reflections included in the refinement: 0.1478
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No