Information card for entry 7105385

Structure parameters

• Formula: C104 H27 Co3 N23 O21 P4
• Calculated formula: C101 H27 Co3 N23 O21 P4
• Title of publication: Tri-, deca- and dodecanuclear Co(iii)‒pyrazolate metallacycles
• Authors of publication: Miras, Haralampos N.; Chakraborty, Indranil; Raptis, Raphael G.
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 15
• Pages of publication: 2569
• a: 33.33 ± 0.007 Å
• b: 16.335 ± 0.003 Å
• c: 19.603 ± 0.004 Å
• α: 90°
• β: 109.2 ± 0.03°
• γ: 90°
• Cell volume: 10079 ± 4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1338
• Residual factor for significantly intense reflections: 0.0739
• Weighted residual factors for significantly intense reflections: 0.1957
• Weighted residual factors for all reflections included in the refinement: 0.2294
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No