Information card for entry 7118942

Structure parameters

• Formula: C69 H98 Li2 N8
• Calculated formula: C69 H97.997 Li2 N8
• Title of publication: CH3-deprotonation of 9-methylanthracene under mild conditions.
• Authors of publication: Finkelmeier, Nils; Visscher, Arne; Wandtke, Sebastian; Herbst-Irmer, Regine; Stalke, Dietmar
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 31
• Pages of publication: 5440 - 5442
• a: 9.486 ± 0.002 Å
• b: 34.841 ± 0.003 Å
• c: 19.391 ± 0.002 Å
• α: 90°
• β: 93.77 ± 0.02°
• γ: 90°
• Cell volume: 6394.9 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0703
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1466
• Weighted residual factors for all reflections included in the refinement: 0.1595
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No