Information card for entry 4342310

Structure parameters

• Formula: C26 H31 Al
• Calculated formula: C26 H31 Al
• SMILES: C[Al](c1c(cccc1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)C
• Title of publication: Reaction of a germylene, stannylene, or plumbylene with trimethylaluminum and trimethylgallium: insertion into Al-C or ga-C bonds, a reversible metal-carbon insertion equilibrium, and a new route to diplumbenes.
• Authors of publication: Erickson, Jeremy D.; Fettinger, James C.; Power, Philip P.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 4
• Pages of publication: 1940 - 1948
• a: 15.1913 ± 0.0006 Å
• b: 9.7004 ± 0.0004 Å
• c: 16.6409 ± 0.0007 Å
• α: 90°
• β: 112.141 ± 0.0017°
• γ: 90°
• Cell volume: 2271.41 ± 0.16 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No