Information card for entry 7118456

Structure parameters

• Formula: C15 H12 F N3
• Calculated formula: C15 H12 F N3
• 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: 5.673 ± 0.0007 Å
• b: 15.311 ± 0.002 Å
• c: 15.16 ± 0.0019 Å
• α: 90°
• β: 103.5 ± 0.012°
• γ: 90°
• Cell volume: 1280.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.1098
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for significantly intense reflections: 0.1387
• Weighted residual factors for all reflections included in the refinement: 0.174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No