Information card for entry 7031883

Structure parameters

• Formula: C0.25 H4.5 Cl0.5 Cu0.5 N1.5 O2.75
• Calculated formula: C0.25 H5 Cl0.5 Cu0.5 N1.5 O2.75
• Title of publication: A magnetically isolated cuprate spin-ladder system: synthesis, structures, and magnetic properties.
• Authors of publication: Zhang, Xiao; Nishihara, Sadafumi; Nakano, Yuki; Yoshida, Erina; Kato, Chisato; Ren, Xiao-Ming; Maryunina, Kseniya Yu; Inoue, Katsuya
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 34
• Pages of publication: 12974
• a: 9.277 ± 0.003 Å
• b: 17.304 ± 0.006 Å
• c: 4.793 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 769.4 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.0666
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1509
• Weighted residual factors for all reflections included in the refinement: 0.1539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7031701
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No