Information card for entry 7707291

Structure parameters

• Chemical name: Ru-sac
• Formula: C16 H20 N2 O10 Ru S3
• Calculated formula: C16 H20 N2 O10 Ru S3
• SMILES: [Ru]([S](=O)(C)C)([OH2])(N1S(=O)(=O)c2c(C1=O)cccc2)(N1S(=O)(=O)c2ccccc2C1=O)([OH2])[OH2]
• Title of publication: Kinetically labile ruthenium(II) complexes of terpyridines and saccharin: effect of substituents on photoactivity, solvation kinetics, and photocytotoxicity.
• Authors of publication: Kumar, Priyaranjan; Singh, Prerana; Saren, Sanjoy; Pakira, Sandip; Sivakumar, Sri; Patra, Ashis K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 23
• Pages of publication: 8196 - 8217
• a: 7.0672 ± 0.0007 Å
• b: 7.7987 ± 0.0007 Å
• c: 20.999 ± 0.002 Å
• α: 88.464 ± 0.002°
• β: 84.971 ± 0.002°
• γ: 71.78 ± 0.002°
• Cell volume: 1095.1 ± 0.18 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 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: 0.0858
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No