Information card for entry 7045096

Structure parameters

• Formula: C15 H13 N O3
• Calculated formula: C15 H13 N O3
• SMILES: C(=O)(c1ccc(cc1)/C=N/c1ccc(cc1)OC)O
• Title of publication: Triphenylstannyl((arylimino)methyl)benzoates with selective potency that induce G1 and G2/M cell cycle arrest and trigger apoptosis via ROS in human cervical cancer cells.
• Authors of publication: Basu Baul, Tushar S.; Longkumer, Imliwati; Duthie, Andrew; Singh, Priya; Koch, Biplob; Guedes da Silva, M Fátima C
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 6
• Pages of publication: 1993 - 2008
• a: 6.1246 ± 0.0005 Å
• b: 57.377 ± 0.004 Å
• c: 7.2367 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2543.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P 21 c a
• Hall space group symbol: P -2ac 2a
• Residual factor for all reflections: 0.1761
• Residual factor for significantly intense reflections: 0.1665
• Weighted residual factors for significantly intense reflections: 0.4128
• Weighted residual factors for all reflections included in the refinement: 0.4293
• Goodness-of-fit parameter for all reflections included in the refinement: 1.713
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No