Information card for entry 4504782

Structure parameters

• Formula: C48 H30 N4 O8
• Calculated formula: C48 H30 N4 O8
• Title of publication: Self-Assembly of Supramolecular Porphyrin Arrays by Hydrogen Bonding: New Structures and Reflections
• Authors of publication: George, Sumod; Goldberg, Israel
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 3
• Pages of publication: 755
• a: 12.8446 ± 0.0008 Å
• b: 15.0021 ± 0.0011 Å
• c: 21.8715 ± 0.0016 Å
• α: 96.167 ± 0.003°
• β: 97.67 ± 0.004°
• γ: 101.066 ± 0.004°
• Cell volume: 4060.7 ± 0.5 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1373
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.16
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.182
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No