Information card for entry 8107688

Structure parameters

• Formula: C24 H19 N3 O
• Calculated formula: C24 H19 N3 O
• Title of publication: Crystal structure of 2-(5-phenyl-1-(quinolin-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)phenol, C24H19N3O
• Authors of publication: Zeng, Dai; Tan, Kai; Fang, Ziyan; Xing, Aiping
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2023
• Journal volume: 238
• Journal issue: 6
• Pages of publication: 1153 - 1155
• a: 10.4783 ± 0.0005 Å
• b: 11.7171 ± 0.0005 Å
• c: 14.9194 ± 0.0006 Å
• α: 90°
• β: 93.991 ± 0.002°
• γ: 90°
• Cell volume: 1827.29 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• 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: 0.0642
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1397
• Weighted residual factors for all reflections included in the refinement: 0.1508
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No