Information card for entry 7708327

Structure parameters

• Formula: C56 H62 Ho4 N8 O75 Si W12
• Calculated formula: C56 H62 Ho4 N8 O75 Si W12
• Title of publication: Dalton technical issue “Lanthanide and transition metal complexes as molecular magnets Single-molecule magnets within polyoxometalate-based frameworks
• Authors of publication: Babaei Zarch, Malihe; Mirzaei, Masoud; Bazargan, Maryam; Gupta, Sandeep K.; Meyer, Franc; Mague, Joel T.
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 13.2579 ± 0.0004 Å
• b: 23.3768 ± 0.0007 Å
• c: 33.8574 ± 0.001 Å
• α: 90°
• β: 99.999 ± 0.001°
• γ: 90°
• Cell volume: 10333.9 ± 0.5 ų
• Cell temperature: 235 ± 2 K
• Ambient diffraction temperature: 235 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0616
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.0872
• Weighted residual factors for all reflections included in the refinement: 0.0965
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No