Information card for entry 4329956

Structure parameters

• Formula: C22 H26 Cu2 N4 O7
• Calculated formula: C22 H24 Cu2 N4 O7
• Title of publication: A Robust Metal-Organic Framework Constructed from Alkoxo-Bridged Binuclear Nodes and Hexamethylenetetramine Spacers: Crystal Structure and Sorption Studies
• Authors of publication: Elena Ilyes; Mihaela Florea; Augustin M. Madalan; Ionel Haiduc; Vasile I. Parvulescu; Marius Andruh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7954 - 7956
• a: 17.5087 ± 0.0011 Å
• b: 17.5087 ± 0.0011 Å
• c: 15.1964 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4658.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No