Information card for entry 1504500

Structure parameters

• Formula: C19 H24 N2
• Calculated formula: C19 H24 N2
• SMILES: NC(=N\c1c(cccc1C(C)C)C(C)C)/c1ccccc1
• Title of publication: Addition of amines to nitriles catalyzed by ytterbium amides: an efficient one-step synthesis of monosubstituted N-arylamidines.
• Authors of publication: Wang, Junfeng; Xu, Fan; Cai, Tao; Shen, Qi
• Journal of publication: Organic letters
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 3
• Pages of publication: 445 - 448
• a: 11.3234 ± 0.0016 Å
• b: 14.786 ± 0.002 Å
• c: 10.2105 ± 0.0015 Å
• α: 90°
• β: 93.313 ± 0.004°
• γ: 90°
• Cell volume: 1706.7 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 3
• 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: 0.0822
• Residual factor for significantly intense reflections: 0.0713
• Weighted residual factors for significantly intense reflections: 0.1784
• Weighted residual factors for all reflections included in the refinement: 0.1852
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No