Information card for entry 4321614

Structure parameters

• Common name: K2CuMesitylPorphyrin
• Formula: C70 H82 Cu K2 N4 O14
• Calculated formula: C70 H74 Cu K2 N4 O14
• Title of publication: Facile Synthesis of Stacked, Heteronuclear Porphyrin Arrays with Varied Architectures
• Authors of publication: Michael Harmjanz; Michael J. Scott
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 5428 - 5429
• a: 11.2933 ± 0.0006 Å
• b: 12.173 ± 0.0007 Å
• c: 13.6504 ± 0.0008 Å
• α: 105.33 ± 0.001°
• β: 102.406 ± 0.001°
• γ: 102.151 ± 0.001°
• Cell volume: 1694.88 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0524
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No