Information card for entry 7104715

Structure parameters

• Formula: C40 H28 Mg N2 O10
• Calculated formula: C40 H24 Mg N2 O10
• Title of publication: Selective gas adsorption in a magnesium-based metal-organic framework.
• Authors of publication: Cheon, Young Eun; Park, Jungeun; Suh, Myunghyun Paik
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 36
• Pages of publication: 5436 - 5438
• a: 25.16 ± 0.02 Å
• b: 36.592 ± 0.018 Å
• c: 15.7272 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14479 ± 14 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 74
• Hermann-Mauguin space group symbol: I m m a
• Hall space group symbol: -I 2b 2
• Residual factor for all reflections: 0.2456
• Residual factor for significantly intense reflections: 0.1109
• Weighted residual factors for significantly intense reflections: 0.2728
• Weighted residual factors for all reflections included in the refinement: 0.3181
• Goodness-of-fit parameter for all reflections included in the refinement: 0.879
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No