Information card for entry 2206560

Structure parameters

• Chemical name: Poly[[diaquatris(μ~2~-4,4'-bipyridine-κ^2^N,N')tetrakis(phenylacetato- κO)dinickel(II)] dihydrate]
• Formula: C62 H60 N6 Ni2 O12
• Calculated formula: C62 H60 N6 Ni2 O12
• Title of publication: Poly[[diaquatris(μ~2~-4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')tetrakis(phenylacetato-κ<i>O</i>)dinickel(II)] dihydrate]
• Authors of publication: Zhang, Xue-Li; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: m1498 - m1500
• a: 10.1103 ± 0.0006 Å
• b: 11.2803 ± 0.0006 Å
• c: 13.2962 ± 0.0008 Å
• α: 83.458 ± 0.001°
• β: 83.829 ± 0.001°
• γ: 74.64 ± 0.001°
• Cell volume: 1447.97 ± 0.14 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.082
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.18
• Weighted residual factors for all reflections included in the refinement: 0.196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes