Information card for entry 7104057

Structure parameters

• Formula: C20 H20 Cu2 N2 O11
• Calculated formula: C20 H20 Cu2 N2 O10.98
• 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: 21.351 ± 0.002 Å
• b: 13.1381 ± 0.0013 Å
• c: 8.5699 ± 0.0009 Å
• α: 90°
• β: 101.007 ± 0.002°
• γ: 90°
• Cell volume: 2359.8 ± 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: 0.0465
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7113566
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No