Information card for entry 7150017

Structure parameters

• Formula: C168 H134 Cl8 N4 O4
• Calculated formula: C168 H134 Cl8 N4 O4
• Title of publication: Extremely large cavity assembled by self-interlocking of distorted biconcave porphyrins.
• Authors of publication: Uno, Hidemitsu; Watanabe, Hikaru; Yamashita, Yuko; Ono, Noboru
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2005
• Journal volume: 3
• Journal issue: 3
• Pages of publication: 448 - 453
• a: 19.72 ± 0.001 Å
• b: 19.72 ± 0.001 Å
• c: 35.239 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13703.7 ± 1.8 ų
• Cell temperature: 173.2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for significantly intense reflections: 0.0968
• Weighted residual factors for all reflections included in the refinement: 0.2407
• Goodness-of-fit parameter for all reflections included in the refinement: 1.214
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No