Information card for entry 7055975

Structure parameters

• Formula: C28 H46 Cu2 Mo8 N12 O35
• Calculated formula: C28 H35 Cu2 Mo8 N12 O35
• Title of publication: Three β-octamolybdate-based supramolecular hybrids constructed from a bis-imidazolyl-bis-amide ligand: fast and selective adsorption activities of organic dyes
• Authors of publication: Wang, Xiu-Li; Zhang, Shan; Wang, Xiang; Zhang, Hui-Xiu; Xu, Na; Li, Tian-Jiao
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 5
• Pages of publication: 2178
• a: 10.4739 ± 0.0008 Å
• b: 24.6254 ± 0.0018 Å
• c: 21.3617 ± 0.0016 Å
• α: 90°
• β: 90.085 ± 0.001°
• γ: 90°
• Cell volume: 5509.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0797
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No