Information card for entry 7062904

Structure parameters

• Formula: C42 H48 Cu2 Mo6 N18 O44 Te
• Calculated formula: C42 H48 Cu2 Mo6 N18 O44 Te
• Title of publication: Two new 6-nitrobenzimidazole ligand-modified polymolybdate-based metal–organic complexes with excellent capacitive and electrocatalytic performances
• Authors of publication: Liang, Ju-Ju; Zhang, Yu-Chen; Chang, Zhi-Han; Chen, Yong-Zhen; Chen, Ke-Ke; Lu, Jun-Jun; Wang, Xiu-Li
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• Journal volume: 48
• Journal issue: 3
• Pages of publication: 1248 - 1253
• a: 17.2067 ± 0.0015 Å
• b: 10.6738 ± 0.001 Å
• c: 18.1356 ± 0.0016 Å
• α: 90°
• β: 91.509 ± 0.002°
• γ: 90°
• Cell volume: 3329.6 ± 0.5 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 7
• 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: 0.0613
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No