Information card for entry 7154213

Structure parameters

• Formula: C26 H20 N2 O5
• Calculated formula: C26 H20 N2 O5
• SMILES: c1(cc2c(c(c(/C=C/c3ccc(c(c3)OC)O)nc2cc1)C(=O)C)c1ccccc1)N(=O)=O
• Title of publication: Regioselective synthesis, antimicrobial evaluation and theoretical studies of 2-styryl quinolines.
• Authors of publication: Kamal, Ahmed; Rahim, Abdul; Riyaz, Sd; Poornachandra, Y.; Balakrishna, Moku; Kumar, C. Ganesh; Hussaini, Syed Mohammed Ali; Sridhar, B.; Machiraju, Pavan Kumar
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2015
• Journal volume: 13
• Journal issue: 5
• Pages of publication: 1347 - 1357
• a: 7.1637 ± 0.0007 Å
• b: 26.057 ± 0.003 Å
• c: 11.5507 ± 0.0011 Å
• α: 90°
• β: 95.513 ± 0.002°
• γ: 90°
• Cell volume: 2146.1 ± 0.4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.1018
• Residual factor for significantly intense reflections: 0.0826
• Weighted residual factors for significantly intense reflections: 0.1581
• Weighted residual factors for all reflections included in the refinement: 0.1668
• Goodness-of-fit parameter for all reflections included in the refinement: 1.25
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No