Information card for entry 8105142

Structure parameters

• Chemical name: 5-((bis(pyridin-2-ylmethyl)amino)methyl)quinolin-8-ol
• Formula: C22 H20 N4 O
• Calculated formula: C22 H20 N4 O
• Title of publication: Crystal structure of 5-((bis(pyridin-2-ylmethyl)amino)methyl)quinolin-8-ol, C22H20N4O
• Authors of publication: Jia, Liu; Xu-Liang, Nie; Zhong-Ping, Yin; Da-Yong, Peng; Xu-Gen, Shi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 2
• Pages of publication: 465 - 467
• a: 11.1861 ± 0.0014 Å
• b: 8.1418 ± 0.001 Å
• c: 20.461 ± 0.003 Å
• α: 90°
• β: 97.433 ± 0.001°
• γ: 90°
• Cell volume: 1847.8 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0926
• Weighted residual factors for all reflections included in the refinement: 0.1002
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No