Information card for entry 7033446

Structure parameters

• Formula: C40 H24 Ag N21 Ni2 O11
• Calculated formula: C40 H24 Ag N21 Ni2 O11
• Title of publication: Pyrazine-imide complexes: reversible redox and MOF building blocks.
• Authors of publication: Cowan, Matthew G.; Miller, Reece G.; Brooker, Sally
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 6
• Pages of publication: 2880 - 2892
• a: 14.619 ± 0.003 Å
• b: 24.806 ± 0.004 Å
• c: 9.861 ± 0.004 Å
• α: 90°
• β: 122.003 ± 0.007°
• γ: 90°
• Cell volume: 3032.5 ± 1.5 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0848
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.1807
• Weighted residual factors for all reflections included in the refinement: 0.1901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No