Information card for entry 4313761

Structure parameters

• Formula: C11 H22 F6 N5 O6 Os S2
• Calculated formula: C11 H22 F6 N5 O6 Os S2
• SMILES: [OsH]12([n]3ccccc3)([NH2]CC[NH2]1)[NH2]CC[NH2]2.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Synthesis and Characterization of trans-[Os(en)2py(H)]2+ and Related Studies
• Authors of publication: J. Scott McQueen; Noriharu Nagao; Todd Eberspacher; Z. W. Li; Henry Taube
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3815 - 3821
• a: 10.021 ± 0.002 Å
• b: 10.33 ± 0.002 Å
• c: 12.47 ± 0.003 Å
• α: 94.81 ± 0.03°
• β: 111.03 ± 0.03°
• γ: 111.25 ± 0.03°
• Cell volume: 1088.5 ± 0.6 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0329
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for all reflections: 0.07
• Weighted residual factors for significantly intense reflections: 0.0673
• Goodness-of-fit parameter for all reflections: 1.013
• Goodness-of-fit parameter for significantly intense reflections: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No