Information card for entry 1576591

Structure parameters

• Formula: C278 H297 Al7 F244 Ga6 O26 P12
• Calculated formula: C277.996 H297 Al7 F243.991 Ga6 O25.999 P12
• Title of publication: Why is a dicationic digallene so reactive towards activation of strong covalent bonds? Scope and mechanistic investigations.
• Authors of publication: Barthélemy, Antoine; Kub, Nico Gino; Regnat, Celine; Scherer, Harald; Krossing, Ingo
• Journal of publication: Chemical science
• Year of publication: 2026
• Journal volume: 17
• Journal issue: 8
• Pages of publication: 4004 - 4020
• a: 18.462 ± 0.005 Å
• b: 27.562 ± 0.006 Å
• c: 37.435 ± 0.009 Å
• α: 86.961 ± 0.006°
• β: 88.862 ± 0.007°
• γ: 75.387 ± 0.01°
• Cell volume: 18406 ± 8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1243
• Residual factor for significantly intense reflections: 0.099
• Weighted residual factors for significantly intense reflections: 0.2598
• Weighted residual factors for all reflections included in the refinement: 0.2809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No