Information card for entry 2017016

Structure parameters

• Chemical name: Poly[[bis(2,2'-bipyridine)-μ~4~-itaconato-di-μ~3~-itaconato-digadolinium(III)] tetrahydrate]
• Formula: C35 H36 Gd2 N4 O16
• Calculated formula: C35 H28 Gd2 N4 O16
• Title of publication: Three lanthanide complexes derived from itaconic acid and 2,2'-bipyridine
• Authors of publication: Muñoz, Juan Carlos; Atria, Ana María; Garland, Maria Teresa; Baggio, Ricardo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: m121 - m127
• a: 9.5507 ± 0.0019 Å
• b: 12.598 ± 0.003 Å
• c: 17.582 ± 0.004 Å
• α: 71.6 ± 0.03°
• β: 82.32 ± 0.03°
• γ: 68.39 ± 0.03°
• Cell volume: 1865.9 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0914
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for significantly intense reflections: 0.1928
• Weighted residual factors for all reflections included in the refinement: 0.2043
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes