Information card for entry 4075998

Structure parameters

• Formula: C10 H20 F3 N3 Na O10 Rh S
• Calculated formula: C10 H20 F3 N3 Na O10 Rh S
• SMILES: [Rh]12(OC=O)(OC=O)(OC=O)[NH]3CC[NH]1CC[NH]2CC3.S(=O)(=O)([O-])C(F)(F)F.[Na+].O
• Title of publication: Aqueous Transformation of a Metal Diformate to a Metal Dihydride Carbonyl Complex Accompanied by H2Evolution from the Formato Ligands
• Authors of publication: Ogo, Seiji; Nishida, Hiromi; Hayashi, Hideki; Murata, Yusuke; Fukuzumi, Shunichi
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 20
• Pages of publication: 4816
• a: 12.0327 ± 0.0008 Å
• b: 12.6956 ± 0.0007 Å
• c: 13.5546 ± 0.0009 Å
• α: 90°
• β: 108.144 ± 0.002°
• γ: 90°
• Cell volume: 1967.7 ± 0.2 ų
• Cell temperature: 293.2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No