Information card for entry 7029329

Structure parameters

• Formula: C86 H124 B27 Cl10 F9 N3 O9 P6 Rh3 S6
• Calculated formula: C86 H121 B27 Cl10 F9 N3 O9 P6 Rh3 S6
• Title of publication: Unusual cationic rhodathiaboranes: synthesis and characterization of [8,8,8-(H)(PR3)2-9-(Py)-nido-8,7-RhSB9H10](+) and [1,3-μ-(H)-1,1-(PR3)2-3-(Py)-isonido-1,2-RhSB9H8](+).
• Authors of publication: Calvo, Beatriz; Macías, Ramón; Artigas, Maria Jose; Lahoz, Fernando J.; Oro, Luis A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 13
• Pages of publication: 5121 - 5133
• a: 15.722 ± 0.003 Å
• b: 17.815 ± 0.004 Å
• c: 23.47 ± 0.005 Å
• α: 106.782 ± 0.004°
• β: 96.41 ± 0.004°
• γ: 94.265 ± 0.004°
• Cell volume: 6215 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1838
• Residual factor for significantly intense reflections: 0.0747
• Weighted residual factors for significantly intense reflections: 0.1485
• Weighted residual factors for all reflections included in the refinement: 0.1906
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No