Information card for entry 7106497

Structure parameters

• Formula: C6 H4 Cu2 N2 O7
• Calculated formula: C6 H Cu2 N2 O7
• Title of publication: Structural interconversion between a chain polymer and a two-dimensional network accompanied by tunable magnetic properties
• Authors of publication: Chao Chen; Jian-Ke Sun; Wei Li; Chang-Neng Chen; Jie Zhang
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Pages of publication: 6683
• a: 4.9845 ± 0.0009 Å
• b: 9.456 ± 0.002 Å
• c: 18.431 ± 0.005 Å
• α: 90°
• β: 90.803 ± 0.015°
• γ: 90°
• Cell volume: 868.6 ± 0.3 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: 0.0618
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1643
• Weighted residual factors for all reflections included in the refinement: 0.2311
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No