Information card for entry 7216767

Structure parameters

• Formula: C22 H36 N6 Ni3 O26
• Calculated formula: C22 H36 N6 Ni3 O26
• Title of publication: Strong Antiferromagnetic Interaction in a 3D Copper-Organic Framework and Spin-glass-like Behaviour in a 1D Nickel Compound
• Authors of publication: Liao, Shengyun; Li, Tianhao; Tian, Jin-Lei; Yang, Linyan; Gu, Wen; Liu, Xin
• Journal of publication: RSC Advances
• Year of publication: 2014
• a: 6.958 ± 0.002 Å
• b: 10.909 ± 0.004 Å
• c: 11.877 ± 0.004 Å
• α: 82.523 ± 0.01°
• β: 82.286 ± 0.01°
• γ: 71.561 ± 0.009°
• Cell volume: 843.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0701
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1225
• Weighted residual factors for all reflections included in the refinement: 0.1298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No