Information card for entry 4117016

Structure parameters

• Formula: C64 H70 N4 O18
• Calculated formula: C64 H70 N4 O18
• Title of publication: Hydrogen-Bonded Porphyrinic Solids: Supramolecular Networks of Octahydroxy Porphyrins
• Authors of publication: P. Bhyrappa; Scott R. Wilson; Kenneth S. Suslick
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1997
• Journal volume: 119
• Pages of publication: 8492 - 8502
• a: 7.245 ± 0.002 Å
• b: 14.727 ± 0.003 Å
• c: 14.835 ± 0.004 Å
• α: 90.18 ± 0.02°
• β: 92.9 ± 0.02°
• γ: 90.02 ± 0.02°
• Cell volume: 1580.8 ± 0.7 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 198 ± 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: 0.1971
• Residual factor for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections: 0.3561
• Weighted residual factors for significantly intense reflections: 0.28
• Goodness-of-fit parameter for all reflections: 1.06
• Goodness-of-fit parameter for significantly intense reflections: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No