Information card for entry 7714606

Structure parameters

• Formula: C64 H58 Cu4 Mo22 N24 O83 P2 V4
• Calculated formula: C64 H56 Cu4 Mo22.076 N24 O83 P2 V3.924
• Title of publication: Copper-containing POM-based hybrid P2Mo22V4Cu4 nanocluster as heterogeneous catalyst for the light-driven hydroxylation of benzene to phenol.
• Authors of publication: Chen, Qun; Jiao, Cheng-Yang; Xu, Hu; Li, Si-Man; Yang, Jian-Bo; Mei, Hua; Xu, Yan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1190 - 1195
• a: 12.746 ± 0.004 Å
• b: 14.053 ± 0.004 Å
• c: 19.212 ± 0.006 Å
• α: 73.689 ± 0.004°
• β: 77.538 ± 0.004°
• γ: 66.914 ± 0.003°
• Cell volume: 3016.4 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0774
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1369
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No