Information card for entry 7015933

Structure parameters

• Formula: C42 H56 B9 P3 Rh S
• Calculated formula: C42.24 H49 B9 P3 Rh S
• Title of publication: Chemistry of 11-vertex rhodathiaboranes: reactions with monodentate phosphines.
• Authors of publication: Calvo, Beatriz; Kess, Martin; Macías, Ramón; Cunchillos, Carmen; Lahoz, Fernando J.; Kennedy, John D.; Oro, Luis A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 24
• Pages of publication: 6555 - 6564
• a: 11.496 ± 0.001 Å
• b: 12.603 ± 0.001 Å
• c: 17.124 ± 0.001 Å
• α: 75.935 ± 0.001°
• β: 82.607 ± 0.001°
• γ: 65.07 ± 0.001°
• Cell volume: 2181.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.1091
• Weighted residual factors for all reflections included in the refinement: 0.1105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7378 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No