Information card for entry 2014447

Structure parameters

• Chemical name: Dicarbonyl(tropolonato)rhodium(I)
• Formula: C9 H5 O4 Rh
• Calculated formula: C9 H5 O4 Rh
• SMILES: [Rh]1(OC2C(=[O]1)C=CC=CC=2)(C#[O])C#[O]
• Title of publication: Dicarbonyl(tropolonato)rhodium(I), a redetermination
• Authors of publication: Steyl, Gideon; Roodt, Andreas; Kruger, Gert J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: m473 - m475
• a: 3.683 ± 0.001 Å
• b: 21.856 ± 0.004 Å
• c: 11.296 ± 0.003 Å
• α: 90°
• β: 96.32 ± 0.02°
• γ: 90°
• Cell volume: 903.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1121
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No