Information card for entry 7119648

Structure parameters

• Formula: C31 H29 Al F15 O P
• Calculated formula: C31 H29 Al F15 O P
• SMILES: [Al](c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)(c1c(c(c(c(c1F)F)F)F)F)OC[P+](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Interaction of formaldehyde with a water-tolerant frustrated Lewis pair.
• Authors of publication: Ghattas, Ghazi; Bizzarri, Claudia; Hölscher, Markus; Langanke, Jens; Gürtler, Christoph; Leitner, Walter; Subhani, Muhammad Afzal
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2017
• Journal volume: 53
• Journal issue: 22
• Pages of publication: 3205 - 3208
• a: 9.5107 ± 0.0018 Å
• b: 11.529 ± 0.002 Å
• c: 15.63 ± 0.003 Å
• α: 105.489 ± 0.003°
• β: 92.093 ± 0.003°
• γ: 104.513 ± 0.003°
• Cell volume: 1589 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0835
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1412
• Weighted residual factors for all reflections included in the refinement: 0.1634
• Goodness-of-fit parameter for all reflections included in the refinement: 0.915
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No