Information card for entry 7016576

Structure parameters

• Formula: C11 H13 Li N2 O
• Calculated formula: C11 H13 Li N2 O
• Title of publication: Rare-earth metal-mediated addition/cyclization of the 2-cyanobenzoamino anion.
• Authors of publication: Zhang, Jie; Han, Yanan; Chen, Zhenxia; Zhou, Xigeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 36
• Pages of publication: 9098 - 9100
• a: 10.813 ± 0.01 Å
• b: 8.566 ± 0.008 Å
• c: 12.667 ± 0.011 Å
• α: 90°
• β: 99.228 ± 0.012°
• γ: 90°
• Cell volume: 1158.1 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1231
• Residual factor for significantly intense reflections: 0.0835
• Weighted residual factors for significantly intense reflections: 0.2364
• Weighted residual factors for all reflections included in the refinement: 0.2638
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No