Information card for entry 7063583

Structure parameters

• Formula: H100 La6 O116 V23
• Calculated formula: H44 La6 O92 V23
• Title of publication: Breaking Boundaries: Novel Tridecavanadate Polyoxometalate with a Unique Sixfold Tetradentate Coordination Capacity for Lanthanum(III) and a Twofold Bidentate Decavanadate Ligand in a Single Compound
• Authors of publication: Somasundaram, Janaki Devi; Kabzan, Henrich; Gyepes, Róbert; Krivosudský, Lukáš
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• a: 13.213 ± 0.001 Å
• b: 20.8813 ± 0.0016 Å
• c: 18.7007 ± 0.0014 Å
• α: 90°
• β: 97.169 ± 0.002°
• γ: 90°
• Cell volume: 5119.3 ± 0.7 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• 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: 0.049
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No