Information card for entry 7706426

Structure parameters

• Formula: C12 H27 N2 Nb2 O8
• Calculated formula: C12 H27 N2 Nb2 O8
• Title of publication: Designed sol-gel precursors for atomically dispersed Nb and Pb within TiO₂ as catalysts for dihydroxyacetone transformation.
• Authors of publication: Neto, Antonio de Brito Santiago; Alves da Cruz, Márcia Gabriely; Jeanneau, Erwann; Oliveira, Alcineia Conceição; Essayem, Nadine; Mishra, Shashank
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 5
• Pages of publication: 1604 - 1609
• a: 12.8106 ± 0.0013 Å
• b: 10.2674 ± 0.0013 Å
• c: 18.4561 ± 0.0018 Å
• α: 90°
• β: 106.473 ± 0.01°
• γ: 90°
• Cell volume: 2327.9 ± 0.5 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: I 1 2 1
• Hall space group symbol: I 2y
• Residual factor for all reflections: 0.0979
• Residual factor for significantly intense reflections: 0.0809
• Weighted residual factors for significantly intense reflections: 0.2233
• Weighted residual factors for all reflections included in the refinement: 0.2488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No