Information card for entry 7061416

Structure parameters

• Formula: C13 H35 Cr Mo6 N5 Ni O30.5
• Calculated formula: C13 H35 Cr Mo6 N5 Ni O30.5
• Title of publication: A series of polyoxometalate compounds by tuning N sites and numbers of ligands: syntheses, characterization and electrochemical sensing, and photocatalytic and supercapacitor properties
• Authors of publication: Jin, Liang; Ying, Jun; Zhang, Yanping; Sun, Chenxi; Tian, Aixiang; Wang, Xiuli
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 18
• Pages of publication: 8422 - 8432
• a: 12.5532 ± 0.0005 Å
• b: 13.0752 ± 0.0005 Å
• c: 13.5524 ± 0.0006 Å
• α: 104.748 ± 0.001°
• β: 117.564 ± 0.001°
• γ: 92.481 ± 0.001°
• Cell volume: 1873.01 ± 0.13 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 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: 0.0546
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0765
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No