Information card for entry 4348495

Structure parameters

• Formula: C34 H32 Ag N2 O5 P S
• Calculated formula: C34 H32 Ag N2 O5 P S
• SMILES: [Ag]([P](c1c(cccc1)C)(c1ccccc1C)c1ccccc1C)N(S(=O)(=O)C)c1ccc(N(=O)=O)cc1Oc1ccccc1
• Title of publication: Nimesulide Silver Metallodrugs, Containing the Mitochondriotropic, Triaryl Derivatives of Pnictogen; Anticancer Activity against Human Breast Cancer Cells.
• Authors of publication: Banti, Christina N.; Papatriantafyllopoulou, Constantina; Manoli, Maria; Tasiopoulos, Anastasios J.; Hadjikakou, Sotiris K.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 8681 - 8696
• a: 9.46 ± 0.005 Å
• b: 11.154 ± 0.005 Å
• c: 16.521 ± 0.005 Å
• α: 94.375 ± 0.005°
• β: 102.621 ± 0.005°
• γ: 111.303 ± 0.005°
• Cell volume: 1561.5 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0448
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No