Information card for entry 7033444

Structure parameters

• Formula: C10 H16 B0 Cu F3 N5 O7 Si0.5
• Calculated formula: C10 H16 Cu F3 N5 O7 Si0.5
• 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: 6.5429 ± 0.0007 Å
• b: 8.1489 ± 0.0008 Å
• c: 15.3462 ± 0.0015 Å
• α: 81.295 ± 0.005°
• β: 85.364 ± 0.006°
• γ: 87.999 ± 0.006°
• Cell volume: 805.93 ± 0.14 ų
• Cell temperature: 89 ± 2 K
• Ambient diffraction temperature: 89 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0612
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.224
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No