Information card for entry 7113318

Structure parameters

• Formula: C52 H50 Mo O4 S2 Sn
• Calculated formula: C52 H50 Mo O4 S2 Sn
• Title of publication: Unusual coordination of tetrylenes to molybdenum carbonyl fragments
• Authors of publication: Felicitas Lips; Joshua D. Queen; James C. Fettinger; Philip P. Power
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 5561
• a: 13.1027 ± 0.001 Å
• b: 14.4748 ± 0.0011 Å
• c: 14.889 ± 0.0012 Å
• α: 73.751 ± 0.003°
• β: 67.107 ± 0.003°
• γ: 86.712 ± 0.004°
• Cell volume: 2493.3 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0339
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0859
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No