Information card for entry 7110710

Structure parameters

• Formula: C66 H96 Li2 Mo2 N4 Ni O12
• Calculated formula: C66 H96 Li2 Mo2 N4 Ni O12
• Title of publication: Porphyrinogen tetraanion functioning as a polymetallic assembler: nickel-meso-octaethylporphyrinogen binding four transition metal ions at the periphery
• Authors of publication: Bonomo, Lucia; Solari, Euro; Martin, Géraldine; Scopelliti, Rosario; Floriani, Carlo
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 22
• Pages of publication: 2319
• a: 50.392 ± 0.004 Å
• b: 11.614 ± 0.0008 Å
• c: 23.8148 ± 0.0012 Å
• α: 90°
• β: 105.537 ± 0.005°
• γ: 90°
• Cell volume: 13428.4 ± 1.6 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 7
• 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: 0.063
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1303
• Weighted residual factors for all reflections included in the refinement: 0.1411
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No