Information card for entry 2001196

Structure parameters

• Common name: Cobalt(III)sepulchrate cyclo-triphosphate-water(2/7)
• Chemical name: (1,3,6,8,10,13,16,19-octaazabicyclo[6.6.6]eicosane)cobalt(III)cyclo-triphosphate -water (2/7)
• Formula: C12 H37 Co N8 O12.5 P3
• Calculated formula: C12 H34 Co N8 O13 P3
• Title of publication: Structure of two encapsulated cobalt(III) complexes containing <i>cyclo</i>-triphosphate
• Authors of publication: Bacchi, A.; Ferranti, F.; Pelizzi, G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 11
• Pages of publication: 1885 - 1892
• a: 15.887 ± 0.003 Å
• b: 9.858 ± 0.002 Å
• c: 17.568 ± 0.003 Å
• α: 90°
• β: 112.75 ± 0.02°
• γ: 90°
• Cell volume: 2537.3 ± 0.9 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.0644
• Goodness-of-fit parameter for significantly intense reflections: 3.208
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No