Information card for entry 7237651

Structure parameters

• Formula: C45 H61 Cl4 Co4 Mo8 N O24 S8
• Calculated formula: C45 H57 Cl4 Co4 Mo8 N O24 S8
• Title of publication: A bimetallic Co4Mo8 cluster built from Mo8 oxothiomolybdate capped by a Co4-thiacalix[4]arene unit: the observation of the Co‒Mo synergistic effect for binder-free electrocatalysts
• Authors of publication: Zhang, Min; Chen, Mengwei; Bi, Yanfeng; Huang, Liangliang; Zhou, Kun; Zheng, Zhiping
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 20
• Pages of publication: 12893
• a: 16.9518 ± 0.0009 Å
• b: 17.0056 ± 0.0009 Å
• c: 30.0349 ± 0.0014 Å
• α: 90°
• β: 104.113 ± 0.002°
• γ: 90°
• Cell volume: 8397 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• 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: 0.1102
• Residual factor for significantly intense reflections: 0.0896
• Weighted residual factors for significantly intense reflections: 0.2467
• Weighted residual factors for all reflections included in the refinement: 0.2593
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No