Information card for entry 4303023

Structure parameters

• Formula: C382 H386 Cl24 N28 O2 Zn4
• Calculated formula: C382 H386 Cl24 N28 O2 Zn4
• Title of publication: Three-Component Noncovalent Assembly Consisting of a Central Tetrakis-4-pyridyl Porphyrin and Two Lateral Gable-Like Bis-Zn Porphyrins
• Authors of publication: Maryline Beyler; Valérie Heitz; Jean-Pierre Sauvage; Barbara Ventura; Lucia Flamigni; Kari Rissanen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 8263 - 8270
• a: 43.456 ± 0.0008 Å
• b: 32.734 ± 0.0006 Å
• c: 16.233 ± 0.0005 Å
• α: 90°
• β: 93.049 ± 0.004°
• γ: 90°
• Cell volume: 23058.6 ± 0.9 ų
• Cell temperature: 123 ± 0.1 K
• Ambient diffraction temperature: 123 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1623
• Residual factor for significantly intense reflections: 0.1257
• Weighted residual factors for significantly intense reflections: 0.34
• Weighted residual factors for all reflections included in the refinement: 0.3632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.263
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No