Information card for entry 7220833

Structure parameters

• Formula: C26 H64 Cr2 Cu3 Mo12 N12 O64
• Calculated formula: C26 H28 Cr2 Cu3 Mo12 N12 O64
• Title of publication: Application of flexible bis-pyrazine-bis-amide ligands to construct various polyoxometalate-based metal-organic complexes
• Authors of publication: Wang, Xiuli; Liu, Danna; Lin, Hongyan; Liu, Guocheng; Han, Na; Luan, Jian; Chang, Zhihan
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 10.678 ± 0.0006 Å
• b: 13.448 ± 0.0008 Å
• c: 14.015 ± 0.0008 Å
• α: 105.587 ± 0.001°
• β: 102.566 ± 0.001°
• γ: 93.589 ± 0.0011°
• Cell volume: 1876.32 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0554
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No