Information card for entry 7101236

Structure parameters

• Formula: C8 H8 O4 Zn
• Calculated formula: C8 H8 O4 Zn
• Title of publication: Thermodynamic and kinetic factors in the hydrothermal synthesis of hybrid frameworks: zinc 4-cyclohexene-1,2-dicarboxylates
• Authors of publication: Lee, Clare; Mellot-Draznieks, Caroline; Slater, Ben; Wu, G.; Harrison, William T. A.; Rao, C. N. R.; Cheetham, Anthony K.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2006
• Journal issue: 25
• Pages of publication: 2687 - 2689
• a: 11.8544 ± 0.0014 Å
• b: 13.011 ± 0.0013 Å
• c: 11.8523 ± 0.0013 Å
• α: 90°
• β: 102.379 ± 0.002°
• γ: 90°
• Cell volume: 1785.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0855
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No