Information card for entry 4301221

Structure parameters

• Formula: C63 H36 N7 O8 Zn3
• Calculated formula: C63 H36 N7 O8 Zn3
• Title of publication: Pillared Porphyrin Homologous Series: Intergrowth in Metal-Organic Frameworks
• Authors of publication: Eun-Young Choi; Paul M. Barron; Richard W. Novotny; Hyun-Tak Son; Chunhua Hu; Wonyoung Choe
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 426 - 428
• a: 16.7122 ± 0.0002 Å
• b: 16.7122 ± 0.0002 Å
• c: 54.2436 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 15150.1 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• Residual factor for all reflections: 0.0415
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No