Information card for entry 4343035

Structure parameters

• Formula: Cu H K Mo O5
• Calculated formula: Cu K Mo O5
• Title of publication: Orbital Arrangements and Magnetic Interactions in the Quasi-One-Dimensional Cuprates ACuMoO4(OH) (A = Na, K).
• Authors of publication: Nawa, Kazuhiro; Yajima, Takeshi; Okamoto, Yoshihiko; Hiroi, Zenji
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 11
• Pages of publication: 5566 - 5570
• a: 7.98385 ± 0.00017 Å
• b: 6.3156 ± 0.00014 Å
• c: 9.5641 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 482.25 ± 0.03 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0211
• Residual factor for significantly intense reflections: 0.0204
• Weighted residual factors for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections included in the refinement: 0.0531
• Goodness-of-fit parameter for all reflections included in the refinement: 1.245
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No