Information card for entry 7026534

Structure parameters

• Formula: C54.6 H63.8 Cl2 N9 Ni2 O22.3 Tb
• Calculated formula: C54.6 H45 Cl2 N9 Ni2 O22.3 Tb
• 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: 11.998 ± 0.005 Å
• b: 12.117 ± 0.005 Å
• c: 26.99 ± 0.01 Å
• α: 81.4 ± 0.01°
• β: 89.58 ± 0.01°
• γ: 63.28 ± 0.01°
• Cell volume: 3457 ± 2 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: 0.0753
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1526
• Weighted residual factors for all reflections included in the refinement: 0.1663
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No