Information card for entry 7022567

Structure parameters

• Formula: C72 H69 B2 Cl2 Co2 F8 N23 O4
• Calculated formula: C72 H69 B2 Cl2 Co2 F8 N23 O4
• Title of publication: Influencing the coordination mode of tbta (tbta = tris[(1-benzyl-1H-1,2,3-triazol-4-yl)methyl]amine) in dicobalt complexes through changes in metal oxidation states.
• Authors of publication: Schweinfurth, David; Klein, Johannes; Hohloch, Stephan; Dechert, Sebastian; Demeshko, Serhiy; Meyer, Franc; Sarkar, Biprajit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 19
• Pages of publication: 6944 - 6952
• a: 11.2933 ± 0.0004 Å
• b: 11.5315 ± 0.0004 Å
• c: 16.4162 ± 0.0006 Å
• α: 108.969 ± 0.003°
• β: 91.903 ± 0.003°
• γ: 110.416 ± 0.003°
• Cell volume: 1868.67 ± 0.13 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0683
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.0988
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No