Information card for entry 4342824

Structure parameters

• Formula: H66 N13 Na Np2 O84 P2 W18
• Calculated formula: N12.787 Na Np2.213 O84.426 P2 W18
• Title of publication: Unexpected Actinyl Cation-Directed Structural Variation in Neptunyl(VI) A-Type Tri-lacunary Heteropolyoxotungstate Complexes.
• Authors of publication: Berg, John M.; Gaunt, Andrew J.; May, Iain; Pugmire, Alison L.; Reilly, Sean D.; Scott, Brian L.; Wilkerson, Marianne P.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 9
• Pages of publication: 4192 - 4199
• a: 12.8871 ± 0.0011 Å
• b: 16.0745 ± 0.0014 Å
• c: 21.5515 ± 0.0019 Å
• α: 99.134 ± 0.001°
• β: 95.005 ± 0.001°
• γ: 105.864 ± 0.001°
• Cell volume: 4199.7 ± 0.6 ų
• Cell temperature: 141 ± 1 K
• Ambient diffraction temperature: 141 ± 1 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: 0.0887
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for significantly intense reflections: 0.1198
• Weighted residual factors for all reflections included in the refinement: 0.1301
• Goodness-of-fit parameter for all reflections included in the refinement: 1.214
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No