Information card for entry 4029018

Structure parameters

• Common name: ccs25jul12
• Formula: C16 H26 Li N O2
• Calculated formula: C16 H26 Li N O2
• Title of publication: Structures of Lithium N-Monosubstituted Anilides: Trisolvated Monomer to Tetrasolvated Dimer.
• Authors of publication: Su, Chicheung; Guang, Jie; Williard, Paul G.
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2014
• Journal volume: 79
• Journal issue: 3
• Pages of publication: 1032
• a: 10.1089 ± 0.0007 Å
• b: 10.1193 ± 0.0007 Å
• c: 10.1523 ± 0.0007 Å
• α: 63.117 ± 0.003°
• β: 66.551 ± 0.003°
• γ: 63.364 ± 0.003°
• Cell volume: 802.79 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0825
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1571
• Weighted residual factors for all reflections included in the refinement: 0.1686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No