Information card for entry 2017017

Structure parameters

• Chemical name: Poly[diaqua(2,2'-bipyridine)di-μ~3~-itaconato-μ~2~-itaconato- digadolinium(III)]
• Formula: C25 H24 Gd2 N2 O14
• Calculated formula: C25 H18 Gd2 N2 O14
• 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: 16.427 ± 0.005 Å
• b: 18.645 ± 0.005 Å
• c: 9.3 ± 0.003 Å
• α: 90°
• β: 94.949 ± 0.006°
• γ: 90°
• Cell volume: 2837.8 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0791
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.1381
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes