Information card for entry 8105853

Structure parameters

• Formula: C26 H22 N4
• Calculated formula: C26 H22 N4
• Title of publication: Crystal structure of 1,1′-dibenzyl-3,3′-dicyano-1,1′,4,4′-tetrahydro-4,4′-bipyridine, C26H22N4
• Authors of publication: Zhu, Hao; Chen, Shi-Jun; Lin, Yu-Xuann; Zhong, Qi-Di; Sun, Wu-Ji; Zhang, Xiu-Jun
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 4
• Pages of publication: 793 - 794
• a: 11.472 ± 0.002 Å
• b: 6.0805 ± 0.0012 Å
• c: 29.787 ± 0.006 Å
• α: 90°
• β: 92.448 ± 0.003°
• γ: 90°
• Cell volume: 2075.9 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0563
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No