Information card for entry 4131798

Structure parameters

• Formula: C10 H6 N2 S2
• Calculated formula: C10 H6 N2 S2
• Title of publication: Ex Vivo Tracking of Endogenous CO with a Ruthenium(II) Complex.
• Authors of publication: Torre, Cristina de la; Toscani, Anita; Marín-Hernández, Cristina; Robson, Jonathan A.; Terencio, María Carmen; White, Andrew J. P.; Alcaraz, María José; Wilton-Ely, James D E T; Martínez-Máñez, Ramón; Sancenón, Félix
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 51
• Pages of publication: 18484 - 18487
• a: 11.3068 ± 0.0009 Å
• b: 7.0845 ± 0.0005 Å
• c: 23.268 ± 0.002 Å
• α: 90°
• β: 96.544 ± 0.008°
• γ: 90°
• Cell volume: 1851.7 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0706
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1164
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No