Information card for entry 7051767

Structure parameters

• Formula: C84 H58 Br4 Cu4 N12 O7
• Calculated formula: C84 H52 Br4 Cu4 N12 O7
• Title of publication: Molecular tectonics: ribbon type coordination networks based on porphyrins bearing two pyridine or two pyridine N-oxide units
• Authors of publication: Deiters, Emmanuel; Bulach, Véronique; Wais Hosseini, Mir
• Journal of publication: New Journal of Chemistry
• Year of publication: 2008
• Journal volume: 32
• Journal issue: 1
• Pages of publication: 99
• a: 8.1872 ± 0.0003 Å
• b: 14.4491 ± 0.0005 Å
• c: 16.8506 ± 0.0005 Å
• α: 80.749 ± 0.001°
• β: 78.467 ± 0.001°
• γ: 75.415 ± 0.001°
• Cell volume: 1877.34 ± 0.11 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1111
• Residual factor for significantly intense reflections: 0.0795
• Weighted residual factors for significantly intense reflections: 0.2533
• Weighted residual factors for all reflections included in the refinement: 0.2797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No