Information card for entry 7154637

Structure parameters

• Formula: C19 H18 Cl3 N7 O10
• Calculated formula: C19 H18 Cl3 N7 O10
• Title of publication: Hybrids of acylated homoserine lactone and nitric oxide donors as inhibitors of quorum sensing and virulence factors in Pseudomonas aeruginosa.
• Authors of publication: Kutty, Samuel K.; Barraud, Nicolas; Ho, Kitty K. K.; Iskander, George M.; Griffith, Renate; Rice, Scott A.; Bhadbhade, Mohan; Willcox, Mark D. P.; Black, David StC; Kumar, Naresh
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2015
• Journal volume: 13
• Journal issue: 38
• Pages of publication: 9850 - 9861
• a: 12.6131 ± 0.0005 Å
• b: 26.049 ± 0.001 Å
• c: 8.1912 ± 0.0004 Å
• α: 90°
• β: 108.884 ± 0.002°
• γ: 90°
• Cell volume: 2546.43 ± 0.19 ų
• Cell temperature: 156 ± 2 K
• Ambient diffraction temperature: 155.86 K
• Number of distinct elements: 5
• 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: 0.2858
• Residual factor for significantly intense reflections: 0.2697
• Weighted residual factors for significantly intense reflections: 0.667
• Weighted residual factors for all reflections included in the refinement: 0.6748
• Goodness-of-fit parameter for all reflections included in the refinement: 3.511
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No