Information card for entry 7013719

Structure parameters

• Formula: C28 H24 Cl2 N6 Ru
• Calculated formula: C28 H24 Cl2 N6 Ru
• SMILES: c12cccc[n]1[Ru]1([N](c3ccccc3)=N2)(Cl)([n]2c(cccc2)N=[N]1c1ccccc1)Cl.c1ccccc1
• Title of publication: Dichlorobis(2-phenylazopyridine)ruthenium(II) complexes: characterisation, spectroscopic and structural properties of four isomers.
• Authors of publication: Velders, Aldrik H.; van der Schilden, Karlijn; Hotze, Anna C. G.; Reedijk, Jan; Kooijman, Huub; Spek, Anthony L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 3
• Pages of publication: 448 - 455
• a: 9.175 ± 0.003 Å
• b: 9.7409 ± 0.0018 Å
• c: 15.8783 ± 0.0017 Å
• α: 90°
• β: 109.957 ± 0.012°
• γ: 90°
• Cell volume: 1333.9 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0815
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0946
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No