Information card for entry 7704005

Structure parameters

• Formula: C42 H70 B2 Cl Co2 N15 S6 W2
• Calculated formula: C42 H70 B2 Cl Co2 N15 S6 W2
• Title of publication: Templated syntheses of heterometal tungsten-cobalt-sulfur clusters with different nuclearities.
• Authors of publication: Guo, Jia-Ting; Chen, Xu-Dong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 17
• Pages of publication: 5523 - 5530
• a: 12.7233 ± 0.0014 Å
• b: 15.7004 ± 0.0018 Å
• c: 29.118 ± 0.003 Å
• α: 90°
• β: 93.167 ± 0.002°
• γ: 90°
• Cell volume: 5807.8 ± 1.1 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.0324
• Weighted residual factors for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections included in the refinement: 0.0812
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No