Information card for entry 1549552

Structure parameters

• Formula: C2 H12 Cu1.5 O10 P
• Calculated formula: C2 H12 Cu1.5 O10 P
• Title of publication: Synthesis, Crystal Structure, and Characterization of Two Novel One- and Two-Dimensionally Polymeric Copper(II) Phosphonoacetates
• Authors of publication: Köferstein, Roberto; Arnold, Michael; Robl, Christian
• Journal of publication: Zeitschrift für anorganische und allgemeine Chemie
• Year of publication: 2017
• Journal volume: 643
• Journal issue: 3
• Pages of publication: 276
• a: 6.082 ± 0.001 Å
• b: 8.001 ± 0.001 Å
• c: 10.836 ± 0.001 Å
• α: 94.98 ± 0.01°
• β: 105.71 ± 0.01°
• γ: 109.84 ± 0.01°
• Cell volume: 468.08 ± 0.12 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: 0.0451
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for all reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.0527
• Goodness-of-fit parameter for all reflections: 1.143
• Goodness-of-fit parameter for significantly intense reflections: 1.199
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No