Information card for entry 7039039

Structure parameters

• Formula: C55 H107 B2 N35 O106 W24 Zn5
• Calculated formula: C55 H75 B2 N35 O106 W24 Zn5
• Title of publication: Two novel bi-functional hybrid materials constructed from POMs and a Schiff base with excellent third-order NLO and catalytic properties.
• Authors of publication: Hu, Gonghao; Miao, Hao; Mei, Hua; Zhou, Shuai; Xu, Yan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 7947 - 7951
• a: 13.0563 ± 0.0013 Å
• b: 22.736 ± 0.002 Å
• c: 25.199 ± 0.003 Å
• α: 87.645 ± 0.001°
• β: 79.83 ± 0.001°
• γ: 84.888 ± 0.001°
• Cell volume: 7331 ± 1.3 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: 0.1223
• Residual factor for significantly intense reflections: 0.0711
• Weighted residual factors for significantly intense reflections: 0.1506
• Weighted residual factors for all reflections included in the refinement: 0.1682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No