Information card for entry 7704323

Structure parameters

• Formula: C36 H48 Co9 N12 Na14 O202 P12 Se4 W24
• Calculated formula: C36 H48 Co9 N12 Na14 O202 P12 Se4 W24
• 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: 18.1321 ± 0.0014 Å
• b: 18.8474 ± 0.0014 Å
• c: 20.315 ± 0.0015 Å
• α: 85.563 ± 0.001°
• β: 86.474 ± 0.001°
• γ: 62.93 ± 0.001°
• Cell volume: 6160.7 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0844
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.1596
• Weighted residual factors for all reflections included in the refinement: 0.1758
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No