Information card for entry 7707073

Structure parameters

• Formula: C18 H24 Cl2 N4 Ru
• Calculated formula: C18 H24 Cl2 N4 Ru
• SMILES: [Ru]12345(Cl)(Cl)([n]6cnn7c6nc(c(c7C)C)C)[c]6([cH]1[cH]2[c]3([cH]4[cH]56)C(C)C)C
• Title of publication: New organometallic ruthenium(ii) complexes with purine analogs - a wide perspective on their biological application.
• Authors of publication: Fandzloch, Marzena; Jędrzejewski, Tomasz; Dobrzańska, Liliana; Esteban-Parra, Ginés M; Wiśniewska, Joanna; Paneth, Agata; Paneth, Piotr; Sitkowski, Jerzy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 16
• Pages of publication: 5557 - 5573
• a: 16.2609 ± 0.0002 Å
• b: 13.8629 ± 0.0001 Å
• c: 17.0202 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3836.75 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0361
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0838
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No