Information card for entry 7243451

Structure parameters

• Formula: C17 H88 Ce2.5 N2.5 O91 P4 W16
• Calculated formula: C14 H16 Ce2.5 N O85.5 P4 W16
• Title of publication: A phosphonate–lanthanoid polyoxometalate coordination polymer: {Ce2P2W16O60L2}n zipper chains
• Authors of publication: Wang, Wenyan; Izarova, Natalya V.; van Leusen, Jan; Kögerler, Paul
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 35
• Pages of publication: 5989 - 5993
• a: 25.85 ± 0.005 Å
• b: 13.375 ± 0.003 Å
• c: 27.037 ± 0.005 Å
• α: 90°
• β: 91.89 ± 0.03°
• γ: 90°
• Cell volume: 9343 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0708
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1891
• Weighted residual factors for all reflections included in the refinement: 0.1919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No