Information card for entry 4342721

Structure parameters

• Formula: C10 H15 F6 N2 O2 P Ru
• Calculated formula: C10 H15 F6 N2 O2 P Ru
• SMILES: [Ru]1234567([NH2][C@H](C(=O)O2)CC[NH2]1)[cH]1[cH]3[cH]4[cH]5[cH]6[cH]71.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Selective Lability of Ruthenium(II) Arene Amino Acid Complexes.
• Authors of publication: Scrase, Tom G.; O'Neill, Michael J; Peel, Andrew J.; Senior, Paul W.; Matthews, Peter D.; Shi, Heyao; Boss, Sally R.; Barker, Paul D.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 3118 - 3124
• a: 5.9864 ± 0.00001 Å
• b: 8.5702 ± 0.00001 Å
• c: 27.2074 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1395.87 ± 0.02 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0396
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.0744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No