Information card for entry 7236498

Structure parameters

• Chemical name: [(p-cymene)bis(chlorido)(hypoxanthine-kN9)ruthenium(II)]
• Formula: C15 H18 Cl2 N4 O Ru
• Calculated formula: C15 H18 Cl2 N4 O Ru
• Title of publication: Supramolecular architectures based on p-cymene/ruthenium complexes functionalized with nucleobases
• Authors of publication: Sce, Fabio; Beobide, Garikoitz; Castillo, Oscar; de Pedro, Imanol; Pérez-Yáñez, Sonia; Reyes, Efraim
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 40
• Pages of publication: 6039
• a: 7.621 ± 0.0003 Å
• b: 25.8409 ± 0.0008 Å
• c: 8.7978 ± 0.0003 Å
• α: 90°
• β: 113.45 ± 0.005°
• γ: 90°
• Cell volume: 1589.48 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.025
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0474
• Weighted residual factors for all reflections included in the refinement: 0.0488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No