Information card for entry 2016810

Structure parameters

• Chemical name: (2E)-3-(2-chloro-6-methylquinolin-3-yl)-1-(5-methylfuran-2-yl)prop-2-en-1-one
• Formula: C18 H14 Cl N O2
• Calculated formula: C18 H14 Cl N O2
• Title of publication: Novel chalcones derived from 2-chloro-3-formyl-6-methylquinoline
• Authors of publication: Rizvi, Umar Farooq; Siddiqui, Hamid Latif; Ahmad, Saeed; Ahmad, Matloob; Parvez, Masood
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: o547 - o549
• a: 36.228 ± 0.01 Å
• b: 7.372 ± 0.003 Å
• c: 11.214 ± 0.005 Å
• α: 90°
• β: 99.7 ± 0.02°
• γ: 90°
• Cell volume: 2952 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes