Information card for entry 7005394

Structure parameters

• Formula: C133 H148 N16 O22
• Calculated formula: C133 H148 N16 O22
• Title of publication: Coordination and structural studies of crowned-porphyrins.
• Authors of publication: Halime, Zakaria; Lachkar, Mohammed; Toupet, Loïc; Coutsolelos, Athanassios G.; Boitrel, Bernard
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 33
• Pages of publication: 3684 - 3689
• a: 14.8938 ± 0.0007 Å
• b: 22.594 ± 0.001 Å
• c: 35.296 ± 0.002 Å
• α: 90°
• β: 101.776 ± 0.004°
• γ: 90°
• Cell volume: 11627.5 ± 1 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.168
• Residual factor for significantly intense reflections: 0.1095
• Weighted residual factors for significantly intense reflections: 0.3279
• Weighted residual factors for all reflections included in the refinement: 0.3504
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No