Information card for entry 4324173

Structure parameters

• Formula: C20 H26 Cu2 N4 O17 P4
• Calculated formula: C20 H20 Cu2 N4 O17 P4
• Title of publication: Pyrophosphate-Mediated Magnetic Interactions in Cu(II) Coordination Complexes
• Authors of publication: Nadia Marino; Oluwatayo. F. Ikotun; Miguel Julve; Francesc Lloret; Juan Cano; Robert P. Doyle
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 378 - 389
• a: 8.4735 ± 0.0008 Å
• b: 9.7033 ± 0.0009 Å
• c: 9.8403 ± 0.0009 Å
• α: 93.399 ± 0.002°
• β: 110.835 ± 0.002°
• γ: 104.247 ± 0.002°
• Cell volume: 723.22 ± 0.12 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0358
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0841
• Weighted residual factors for all reflections included in the refinement: 0.087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No