Information card for entry 7219177

Structure parameters

• Formula: C14 H22 N2 O5 Ru S
• Calculated formula: C14 H22 N2 O5 Ru S
• SMILES: C1(=O)[C@@H]2C[S](C)[Ru]34567([c]8([cH]7[cH]6[c]5([cH]4[cH]38)C)C(C)C)([NH2]2)O1.N(=O)(=O)[O-]
• Title of publication: Half-sandwich complexes of ruthenium, osmium, rhodium and iridium with DL-methionine or S-methyl-L-cysteine: A solid state and solution equilibrium study
• Authors of publication: Patalenszki, János; Bíró, Linda; Benyei, Attila; Muchova, Tereza Radosova; Kasparkova, Jana; Buglyo, Peter
• Journal of publication: RSC Adv.
• Year of publication: 2014
• a: 12.891 ± 0.001 Å
• b: 7.611 ± 0.001 Å
• c: 18.041 ± 0.001 Å
• α: 90°
• β: 99.51 ± 0.01°
• γ: 90°
• Cell volume: 1745.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1564
• Residual factor for significantly intense reflections: 0.0741
• Weighted residual factors for all reflections included in the refinement: 0.168
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No