Information card for entry 4109247

Structure parameters

• Formula: C14 H26 N6 Na2 O9 Ru
• Calculated formula: C14 H8 N6 Na2 O7 Ru
• SMILES: C(#N)[Ru]1(C#N)(C#N)(C#N)[n]2c(c3cccc[n]13)cccc2.[Na+].O.[Na+].O.O.O.O.O.O
• Title of publication: Structural and Photophysical Properties of Adducts of [Ru(bipy)(CN)4]2- with Different Metal Cations: Metallochromism and Its Use in Switching Photoinduced Energy Transfer
• Authors of publication: Theodore Lazarides; Timothy L. Easun; Claire Veyne-Marti; Wassim Z. Alsindi; Michael W. George; Nina Deppermann; Christopher A. Hunter; Harry Adams; Michael D. Ward
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 4014 - 4027
• a: 6.9796 ± 0.001 Å
• b: 30.805 ± 0.004 Å
• c: 10.517 ± 0.0014 Å
• α: 90°
• β: 107.714 ± 0.001°
• γ: 90°
• Cell volume: 2154 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0473
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1175
• Weighted residual factors for all reflections included in the refinement: 0.1245
• Goodness-of-fit parameter for all reflections included in the refinement: 0.732
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No