Information card for entry 7023245

Structure parameters

• Formula: C32 H70 Mo6 N2 O16 P6 S20
• Calculated formula: C32 H70 Mo6 N2 O16 P6 S20
• Title of publication: Tungsten and molybdenum incomplete cuboidal clusters; kinetico-mechanistic studies and association in dimers.
• Authors of publication: Hernandez-Molina, Rita; Gushchin, Artem; González-Platas, Javier; Martínez, Manuel; Rodríguez, Carlos; Vicent, Cristian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 42
• Pages of publication: 15016 - 15027
• a: 14.1592 ± 0.0002 Å
• b: 20.8726 ± 0.0004 Å
• c: 25.038 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7399.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0837
• Residual factor for significantly intense reflections: 0.0694
• Weighted residual factors for significantly intense reflections: 0.176
• Weighted residual factors for all reflections included in the refinement: 0.1907
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No