Information card for entry 7023244

Structure parameters

• Formula: C28 H52 Mo3 N2 O10 P3 S10
• Calculated formula: C28 H52 Mo3 N2 O10 P3 S10
• 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: 12.8385 ± 0.0004 Å
• b: 13.8201 ± 0.0006 Å
• c: 14.9195 ± 0.0006 Å
• α: 104.542 ± 0.004°
• β: 93.902 ± 0.003°
• γ: 108.054 ± 0.004°
• Cell volume: 2405.4 ± 0.18 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0814
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No