Information card for entry 7043116

Structure parameters

• Formula: C26 H32 Ag N2 O3 P
• Calculated formula: C26 H32 Ag N2 O3 P
• SMILES: c1(ccccc1)[P](c1ccccc1)(C1CCCCC1)[Ag]N1C(=O)NC(=O)C(C1=O)(CC)CC
• Title of publication: Synthesis, structures and biomolecular interactions of new silver(I) 5,5-diethylbarbiturate complexes of monophosphines targeting Gram-positive bacteria and breast cancer cells
• Authors of publication: Yilmaz, Veysel T.; Icsel, Ceyda; Batur, Jenaidullah; Aydinlik, Seyma; Cengiz, Murat; Büyükgüngör, Orhan
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 9.3467 ± 0.0005 Å
• b: 11.5535 ± 0.0006 Å
• c: 12.6357 ± 0.0006 Å
• α: 94.402 ± 0.004°
• β: 92.711 ± 0.004°
• γ: 105.575 ± 0.004°
• Cell volume: 1307.23 ± 0.12 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0285
• Residual factor for significantly intense reflections: 0.0235
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.0619
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No