Information card for entry 4501744

Structure parameters

• Formula: C18 H18 Cd N4 O4
• Calculated formula: C18 H18 Cd N4 O4
• Title of publication: Conformational Isomerism of 1,2-Bis(imidazol-1′-yl)ethane Affected by the Orientation of Functional Carboxylate Groups in Cadmium and Cobalt Helical Coordination Polymers
• Authors of publication: Li, Xiaoju; Weng, Xiulan; Tang, Ruijie; Lin, Yuanmiao; Ke, Zhilong; Zhou, Wenbiao; Cao, Rong
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 7
• Pages of publication: 3228
• a: 7.0145 ± 0.0006 Å
• b: 9.6647 ± 0.001 Å
• c: 13.6322 ± 0.0013 Å
• α: 86.145 ± 0.013°
• β: 85.514 ± 0.01°
• γ: 85.699 ± 0.012°
• Cell volume: 916.99 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0528
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No