Information card for entry 7006025

Structure parameters

• Formula: C40 H24 Br4 Hg2 N8 Ni O4
• Calculated formula: C40 H24 Br4 Hg2 N8 Ni O4
• Title of publication: Heterobimetallic coordination networks based on metallaporphyrins bearing four pyridine N-oxide groups as coordinating sites
• Authors of publication: Deiters, Emmanuel; Bulach, Véronique; Hosseini, Mir Wais
• Journal of publication: Dalton Transactions
• Year of publication: 2007
• Journal issue: 37
• Pages of publication: 4126
• a: 15.2904 ± 0.0004 Å
• b: 15.2904 ± 0.0004 Å
• c: 16.7746 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3921.8 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.035
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No