Information card for entry 7242630

Structure parameters

• Formula: C21 H19 Mo4 N6 Ni O18
• Calculated formula: C21 H19 Mo4 N6 Ni O18
• Title of publication: Various amide-derived ligands induced five octamolybdate-based metal‒organic complexes: synthesis, structure, electrochemical sensing and photocatalytic properties
• Authors of publication: Wang, Xiuli; Li, Lei; Wang, Xiang; Zhang, Yuqing
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 30
• Pages of publication: 5176 - 5183
• a: 15.958 ± 0.0009 Å
• b: 16.5096 ± 0.0009 Å
• c: 16.5324 ± 0.001 Å
• α: 90°
• β: 111.402 ± 0.001°
• γ: 90°
• Cell volume: 4055.3 ± 0.4 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• 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: 0.1286
• Residual factor for significantly intense reflections: 0.0852
• Weighted residual factors for significantly intense reflections: 0.2731
• Weighted residual factors for all reflections included in the refinement: 0.3097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No