Information card for entry 4312698

Structure parameters

• Formula: C40 H36 N4 Ni2 O10
• Calculated formula: C40 H32 N4 Ni2 O10
• Title of publication: A New Type of Single-Helix Coordination Polymer with Mixed Ligands [M2(phen)2(e,a-cis-1,4-chdc)2(H2O)2]n (M = Co and Ni; phen = 1,10-phenanthroline; chdc = cyclohexanedicarboxylate)
• Authors of publication: Yanjuan Qi; Yonghui Wang; Changwen Hu; Minhua Cao; Li Mao; Enbo Wang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 8519 - 8523
• a: 9.8921 ± 0.0006 Å
• b: 9.0151 ± 0.0004 Å
• c: 20.1628 ± 0.0017 Å
• α: 90°
• β: 100.31 ± 0.02°
• γ: 90°
• Cell volume: 1769.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0828
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No