Information card for entry 7026535

Structure parameters

• Formula: C54.6 H63.8 Cl2 Gd N9 Ni2 O22.3
• Calculated formula: C54.6 H44 Cl2 Gd N9 Ni2 O22.3
• Title of publication: Initial employment of di-2-pyridyl ketone as a route to nickel(II)/lanthanide(III) clusters: triangular Ni(2)Ln complexes.
• Authors of publication: Efthymiou, Constantinos G.; Georgopoulou, Anastasia N.; Papatriantafyllopoulou, Constantina; Terzis, Aris; Raptopoulou, Catherine P.; Escuer, Albert; Perlepes, Spyros P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 37
• Pages of publication: 8603 - 8605
• a: 11.981 ± 0.006 Å
• b: 12.089 ± 0.006 Å
• c: 26.96 ± 0.01 Å
• α: 81.34 ± 0.02°
• β: 89.48 ± 0.02°
• γ: 63.37 ± 0.02°
• Cell volume: 3443 ± 3 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.0775
• Residual factor for significantly intense reflections: 0.0696
• Weighted residual factors for significantly intense reflections: 0.1865
• Weighted residual factors for all reflections included in the refinement: 0.1989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No