Information card for entry 4070823

Structure parameters

• Formula: C9 H13 Ga
• Calculated formula: C9 H13 Ga
• SMILES: [Ga](c1ccc(cc1)C)(C)C
• Title of publication: Aryl(dimethyl)gallium Compounds and Methyl(diphenyl)gallium: Synthesis, Structure, and Redistribution Reactions
• Authors of publication: Jutzi, Peter; Izundu, Joseph; Neumann, Beate; Mix, Andreas; Stammler, Hans-Georg
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 18
• Pages of publication: 4565
• a: 7.02 ± 0.0003 Å
• b: 7.121 ± 0.0003 Å
• c: 10.309 ± 0.0005 Å
• α: 72.703 ± 0.002°
• β: 76.898 ± 0.003°
• γ: 65.767 ± 0.003°
• Cell volume: 445.43 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No