Information card for entry 2234243

Structure parameters

• Chemical name: (Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl[tris(naphthalen- 1-yl)phosphane-κ<i>P</i>]rhodium(I) acetone hemisolvate
• Formula: C37.5 H31 O3.5 P Rh
• Calculated formula: C37.5 H31 O3.5 P Rh
• SMILES: [Rh]1(OC(=CC(=[O]1)C)C)([P](c1cccc2ccccc12)(c1c2ccccc2ccc1)c1cccc2c1cccc2)C#[O].O=C(C)C
• Title of publication: (Acetylacetonato-κ^2^<i>O</i>,<i>O</i>')carbonyl[tris(naphthalen-1-yl)phosphane-κ<i>P</i>]rhodium(I) acetone hemisolvate
• Authors of publication: Ogutu, Hezron; Meijboom, Reinout
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m394
• a: 19.878 ± 0.0005 Å
• b: 16.935 ± 0.0005 Å
• c: 18.806 ± 0.0004 Å
• α: 90°
• β: 102.916 ± 0.001°
• γ: 90°
• Cell volume: 6170.6 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0295
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for all reflections included in the refinement: 0.0677
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes