Information card for entry 7000457

Structure parameters

• Common name: K(Ru(NO)Cl2(ThiodiglyH-2)) H2O
• Formula: C4 H6 Cl2 K N O6 Ru S
• Calculated formula: C4 H6 Cl2 K N O6 Ru S
• Title of publication: Photoinduced linkage isomerism of {RuNO}6 complexes with bioligands and related chelators
• Authors of publication: Zangl, Anna; Klüfers, Peter; Schaniel, Dominik; Woike, Theo
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 6
• Pages of publication: 1034 - 1045
• a: 13.2788 ± 0.0002 Å
• b: 7.1197 ± 0.0001 Å
• c: 24.9008 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2354.15 ± 0.07 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0326
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for significantly intense reflections: 0.0478
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No