Information card for entry 7118669

Structure parameters

• Formula: C78 H58 Cu7 I6 N22 O2
• Calculated formula: C78 H44 Cu7 I6 N22 O2
• Title of publication: Porphyrin-based mixed-valent Ag(I)/Ag(II) and Cu(I)/Cu(II) networks as efficient heterogeneous catalysts for the azide-alkyne "click" reaction and promising oxidation of ethylbenzene
• Authors of publication: Jiang, Wei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 7
• Pages of publication: 1373 - 1376
• a: 32.206 ± 0.003 Å
• b: 8.802 ± 0.0006 Å
• c: 30.44 ± 0.003 Å
• α: 90°
• β: 108.12 ± 0.011°
• γ: 90°
• Cell volume: 8201.1 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1254
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1451
• Weighted residual factors for all reflections included in the refinement: 0.1791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7118453
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No