Information card for entry 7131135

Structure parameters

• Formula: C53 H30 Al F36 In O4 P2
• Calculated formula: C53 H30 Al F36 In O4 P2
• Title of publication: How long are Ga⇆Ga double bonds and Ga-Ga single bonds in dicationic gallium dimers?
• Authors of publication: Barthélemy, Antoine; Scherer, Harald; Weller, Hanna; Krossing, Ingo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 10
• Pages of publication: 1353 - 1356
• a: 11.504 ± 0.006 Å
• b: 15.151 ± 0.005 Å
• c: 17.514 ± 0.007 Å
• α: 84.274 ± 0.008°
• β: 79.771 ± 0.012°
• γ: 84.889 ± 0.014°
• Cell volume: 2981 ± 2 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: 0.0559
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1296
• Weighted residual factors for all reflections included in the refinement: 0.1388
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No