Information card for entry 4029021

Structure parameters

• Common name: ccs23jul12
• Formula: C17 H28 Li N O2
• Calculated formula: C17 H28 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: 9.9429 ± 0.0013 Å
• b: 9.5568 ± 0.0013 Å
• c: 18.306 ± 0.003 Å
• α: 90°
• β: 97.905 ± 0.004°
• γ: 90°
• Cell volume: 1722.9 ± 0.4 ų
• Cell temperature: 208 ± 2 K
• Ambient diffraction temperature: 208 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0734
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No