Information card for entry 7002949

Structure parameters

• Formula: C110 H113 Co2 F24 N19 O8 P4
• Calculated formula: C110 H113 Co2 F18 N19 O8 P3
• Title of publication: A unique type of a dicobalt cage templated by a weakly coordinated hexafluorophosphate anion: design, structure and solid-state NMR investigations
• Authors of publication: Desmarets, Christophe; Poli, Fabrizia; Le Goff, Xavier F.; Müller, Klaus; Amouri, Hani
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 47
• Pages of publication: 10429 - 10432
• a: 14.301 ± 0.001 Å
• b: 15.56 ± 0.001 Å
• c: 26.631 ± 0.001 Å
• α: 89.288 ± 0.001°
• β: 86.027 ± 0.001°
• γ: 70.023 ± 0.001°
• Cell volume: 5555.7 ± 0.6 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1124
• Residual factor for significantly intense reflections: 0.0842
• Weighted residual factors for significantly intense reflections: 0.2628
• Weighted residual factors for all reflections included in the refinement: 0.2828
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No