Information card for entry 7707134

Structure parameters

• Formula: C26 H26 N4 O14 Re2 S2
• Calculated formula: C26 H26 N4 O14 Re2 S2
• SMILES: c1cccc2c3cccc[n]3[Re](C#[O])(C#[O])(C#[O])([n]12)SS(=O)(=O)[O-].c1cccc2c3cccc[n]3[Re](C#[O])(C#[O])(C#[O])([n]12)[OH2].O.O.O.O
• Title of publication: The effect of sodium thiosulfate on cytotoxicity of a diimine Re(I) tricarbonyl complex.
• Authors of publication: Capper, Miles S.; Enriquez Garcia, Alejandra; Lai, Barry; Wang, Baiwen O.; Gelfand, Benjamin S.; Shemanko, Carrie S.; Jalilehvand, Farideh
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 17
• Pages of publication: 5968 - 5977
• a: 8.0914 ± 0.0001 Å
• b: 7.8966 ± 0.0002 Å
• c: 26.1412 ± 0.0005 Å
• α: 90°
• β: 98.602 ± 0.001°
• γ: 90°
• Cell volume: 1651.49 ± 0.06 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.0286
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0715
• Weighted residual factors for all reflections included in the refinement: 0.0719
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No