Information card for entry 7010836

Structure parameters

• Formula: C26 H30 Al2 N4
• Calculated formula: C26 H30 Al2 N4
• SMILES: c12cccc[n]1[Al](N(c1ccccc1)c1cccc[n]1[Al](N2c1ccccc1)(C)C)(C)C
• Title of publication: The crystallographic observation of molecular lithium oxide: synthesis and solid-state structure of [Me2AlN(2-C5H4N)Ph]2(O)Li2·2THF†
• Authors of publication: Armstrong, David R.; Davies, Robert P.; Linton, David J.; Snaith, Ronald; Schooler, Paul; Wheatley, Andrew E. H.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 19
• Pages of publication: 2838
• a: 8.198 ± 0.004 Å
• b: 8.531 ± 0.004 Å
• c: 9.462 ± 0.006 Å
• α: 107.85 ± 0.04°
• β: 106.44 ± 0.05°
• γ: 94.05 ± 0.04°
• Cell volume: 595.1 ± 0.6 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.106
• Weighted residual factors for all reflections included in the refinement: 0.1106
• Goodness-of-fit parameter for all reflections included in the refinement: 0.688
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No