Information card for entry 7104056

Structure parameters

• Formula: C20 H20 Cu2 N2 O8
• Calculated formula: C20 H20 Cu2 N2 O8
• Title of publication: A 3D metal-organic network, [Cu2(glutarate)2(4,4'-bipyridine)], that exhibits single-crystal to single-crystal dehydration and rehydration.
• Authors of publication: Rather, Beth; Zaworotko, Michael J
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2003
• Journal issue: 7
• Pages of publication: 830 - 831
• a: 21.011 ± 0.002 Å
• b: 13.052 ± 0.0014 Å
• c: 8.5284 ± 0.0009 Å
• α: 90°
• β: 100.679 ± 0.002°
• γ: 90°
• Cell volume: 2298.3 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0859
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7113565
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No