Information card for entry 7051766

Structure parameters

• Formula: C88 H60 Br2 Cd Cl12 N12
• Calculated formula: C88 H60 Br2 Cd Cl12 N12
• 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: 9.4956 ± 0.0004 Å
• b: 14.4774 ± 0.0006 Å
• c: 16.5058 ± 0.0006 Å
• α: 82.058 ± 0.002°
• β: 79.919 ± 0.002°
• γ: 74.55 ± 0.002°
• Cell volume: 2143.27 ± 0.15 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: 0.0614
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1565
• Weighted residual factors for all reflections included in the refinement: 0.1648
• Goodness-of-fit parameter for all reflections included in the refinement: 1.234
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No