Information card for entry 7005744

Structure parameters

• Formula: C29 H30 Mg1.5 N2 O8
• Calculated formula: C29 H30 Mg1.5 N2 O8
• Title of publication: Framework materials assembled from magnesium carboxylate building units.
• Authors of publication: Davies, Robert P.; Less, Robert J.; Lickiss, Paul D.; White, Andrew J. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 24
• Pages of publication: 2528 - 2535
• a: 13.7835 ± 0.0012 Å
• b: 18.384 ± 0.002 Å
• c: 12.1948 ± 0.0015 Å
• α: 90°
• β: 113.96 ± 0.01°
• γ: 90°
• Cell volume: 2823.8 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0551
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1178
• Weighted residual factors for all reflections included in the refinement: 0.1237
• 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