Information card for entry 7704325

Structure parameters

• Formula: C18 H24 Cs2 N6 Na2 Ni4 O90 P6 Se2 W12
• Calculated formula: C18 H24 Cs2 N6 Na2 Ni4 O90 P6 Se2 W12
• Title of publication: Selenotungstates incorporating organophosphonate ligands and metal ions: synthesis, characterization, magnetism and catalytic efficiency in the Knoevenagel condensation reaction.
• Authors of publication: Kong, Hui; He, Peipei; Yang, Zongfei; Xu, Qiaofei; Wang, Jiawei; Ban, Ran; Ma, Pengtao; Wang, Jingping; Niu, Jingyang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 22
• Pages of publication: 7420 - 7425
• a: 16.9074 ± 0.0019 Å
• b: 19.793 ± 0.002 Å
• c: 24.551 ± 0.003 Å
• α: 90.418 ± 0.002°
• β: 104.442 ± 0.002°
• γ: 111.826 ± 0.002°
• Cell volume: 7340.1 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1081
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.1513
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No