Information card for entry 7216766

Structure parameters

• Formula: C10 H7 Cu N3 O5
• Calculated formula: C10 H6.5 Cu N3 O5
• 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: 10.3314 ± 0.0015 Å
• b: 12.3196 ± 0.0018 Å
• c: 19.042 ± 0.003 Å
• α: 106.785 ± 0.003°
• β: 93.694 ± 0.003°
• γ: 94.284 ± 0.003°
• Cell volume: 2304.5 ± 0.6 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0947
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.178
• Weighted residual factors for all reflections included in the refinement: 0.1958
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No