Information card for entry 7039110

Structure parameters

• Formula: C31 H64 Co2 Er N5 O24
• Calculated formula: C28 H42 Co2 Er N5 O18
• Title of publication: Heterometallic trinuclear {CoLn(III)} (Ln = Gd, Tb, Ho and Er) complexes in a bent geometry. Field-induced single-ion magnetic behavior of the Er(III) and Tb(III) analogues.
• Authors of publication: Goura, Joydeb; Brambleby, Jamie; Topping, Craig V.; Goddard, Paul A.; Suriya Narayanan, Ramakirushnan; Bar, Arun Kumar; Chandrasekhar, Vadapalli
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 22
• Pages of publication: 9235 - 9249
• a: 25.231 ± 0.005 Å
• b: 11.986 ± 0.005 Å
• c: 16.814 ± 0.005 Å
• α: 90°
• β: 116.896 ± 0.005°
• γ: 90°
• Cell volume: 4535 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0542
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1194
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No