Information card for entry 2003874

Structure parameters

• Chemical name: aquacarbonylbis(triphenylarsine)rhodium(I) tetrafluoroborate dichloromethane (1/1)
• Formula: C38 H34 As2 B Cl2 F4 O2 Rh
• Calculated formula: C38 H34 As2 B Cl2 F4 O2 Rh
• SMILES: [Rh](C#[O])([As](c1ccccc1)(c1ccccc1)c1ccccc1)([As](c1ccccc1)(c1ccccc1)c1ccccc1)[OH2].ClCCl.[B](F)(F)(F)[F-]
• Title of publication: <i>trans</i>-Aquacarbonylbis(triphenylarsine)rhodium(I) Tetrafluoroborate Dichloromethane Solvate (1/1)
• Authors of publication: Hursthouse, M. B.; Malik, K. M. A.; Evans, E. W.; Howlader, M. B. H.; Atlay, M. T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 9
• Pages of publication: 1782 - 1784
• a: 12.069 ± 0.001 Å
• b: 12.6 ± 0.002 Å
• c: 13.556 ± 0.002 Å
• α: 87.97 ± 0.01°
• β: 67.36 ± 0.01°
• γ: 80.19 ± 0.01°
• Cell volume: 1873.7 ± 0.5 ų
• Cell temperature: 150 ± 0.2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for all reflections: 0.1209
• Weighted residual factors for significantly intense reflections: 0.0724
• Goodness-of-fit parameter for all reflections: 0.341
• Goodness-of-fit parameter for significantly intense reflections: 0.302
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No