Information card for entry 7042109

Structure parameters

• Formula: C75 H66 Br4 Co2 O6 P6
• Calculated formula: C75 H66 Br4 Co2 O6 P6
• Title of publication: Slow magnetic relaxation in a Co(ii) octahedral-tetrahedral system formed of a [CoL3](2+) core with L = bis(diphenylphosphanoxido) methane and tetrahedral [CoBr4](2-) counter anions.
• Authors of publication: Varga, F.; Rajnák, C; Titiš, J; Moncoľ, J; Boča, R
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 13
• Pages of publication: 4148 - 4151
• a: 13.3702 ± 0.0004 Å
• b: 19.4278 ± 0.0006 Å
• c: 28.5245 ± 0.0009 Å
• α: 90°
• β: 90.932 ± 0.003°
• γ: 90°
• Cell volume: 7408.4 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.075
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.09
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No