Information card for entry 7703254

Structure parameters

• Formula: C60 H56 Mo2 O8 P4
• Calculated formula: C60 H56 Mo2 O8 P4
• Title of publication: A dimolybdenum paddlewheel as a building block for heteromultimetallic structures.
• Authors of publication: Knöfel, Nicolai D; Schoo, Christoph; Seifert, Tim P.; Roesky, Peter W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 5
• Pages of publication: 1513 - 1521
• a: 9.9882 ± 0.0004 Å
• b: 8.155 ± 0.0003 Å
• c: 34.8663 ± 0.0009 Å
• α: 90°
• β: 97.262 ± 0.003°
• γ: 90°
• Cell volume: 2817.21 ± 0.17 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• 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: 0.0385
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0709
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No