Information card for entry 7208060

Structure parameters

• Formula: C4 H8 Mg N2 O6
• Calculated formula: C4 H8 Mg N2 O6
• Title of publication: Amine-templated polymeric Mg formates: crystalline scaffolds exhibiting extensive hydrogen bonding
• Authors of publication: Rossin, Andrea; Chierotti, Michele R.; Giambastiani, Giuliano; Gobetto, Roberto; Peruzzini, Maurizio
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 13
• Pages of publication: 4454
• a: 8.709 ± 0.004 Å
• b: 11.587 ± 0.005 Å
• c: 8.28 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 835.5 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.0331
• Residual factor for significantly intense reflections: 0.0293
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No