Information card for entry 7105195

Structure parameters

• Formula: C91 H76 Co2 N11 O3
• Calculated formula: C91 H75 Co2 N11 O3
• Title of publication: Tailoring dicobalt Pacman complexes of Schiff-base calixpyrroles towards dioxygen reduction catalysis.
• Authors of publication: Askarizadeh, Elham; Yaghoob, Sahar Bani; Boghaei, Davar M; Slawin, Alexandra M Z; Love, Jason B
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 5
• Pages of publication: 710 - 712
• a: 14.4714 ± 0.0004 Å
• b: 14.8327 ± 0.0004 Å
• c: 18.857 ± 0.0006 Å
• α: 78.571 ± 0.002°
• β: 75.865 ± 0.002°
• γ: 71.751 ± 0.002°
• Cell volume: 3695.01 ± 0.18 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1237
• Residual factor for significantly intense reflections: 0.1001
• Weighted residual factors for significantly intense reflections: 0.1969
• Weighted residual factors for all reflections included in the refinement: 0.2066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.226
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No