Information card for entry 7706424

Structure parameters

• Formula: C38 H90 N4 O17 Ti4
• Calculated formula: C38 H90 N4 O17 Ti4
• 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: 9.7305 ± 0.0003 Å
• b: 10.3706 ± 0.0004 Å
• c: 13.6626 ± 0.0005 Å
• α: 78.159 ± 0.003°
• β: 80.22 ± 0.003°
• γ: 79.813 ± 0.003°
• Cell volume: 1315.27 ± 0.08 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0781
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for all reflections: 0.1635
• Weighted residual factors for significantly intense reflections: 0.1397
• Weighted residual factors for all reflections included in the refinement: 0.1635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No