Information card for entry 4324175

Structure parameters

• Formula: C48 H50 Cl2 Cu4 N8 O30 P4
• Calculated formula: C48 H50 Cl2 Cu4 N8 O30 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: 7.6464 ± 0.0007 Å
• b: 11.3787 ± 0.0011 Å
• c: 17.3996 ± 0.0016 Å
• α: 79.735 ± 0.002°
• β: 83.813 ± 0.002°
• γ: 84.358 ± 0.002°
• Cell volume: 1476.1 ± 0.2 ų
• Cell temperature: 98 ± 2 K
• Ambient diffraction temperature: 98 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0384
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0919
• Weighted residual factors for all reflections included in the refinement: 0.0995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No