Information card for entry 7005507

Structure parameters

• Formula: C36.5 H41 B9 Cl N P2 Rh
• Calculated formula: C36.5 H41 B9 Cl N P2 Rh
• Title of publication: Polyhedral metallaheteroborane chemistry. Synthesis, spectroscopy, structure and dynamics of eleven-vertex {RhNB(9)} and {PtCB(9)} metallaheteroboranes.
• Authors of publication: Macías, Ramón; Bould, Jonathan; Holub, Josef; Kennedy, John D.; Stíbr, Bohumil; Thornton-Pett, Mark
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 27
• Pages of publication: 2885 - 2897
• a: 9.7567 ± 0.0012 Å
• b: 11.936 ± 0.002 Å
• c: 17.698 ± 0.002 Å
• α: 93.138 ± 0.009°
• β: 94.637 ± 0.009°
• γ: 105.79 ± 0.009°
• Cell volume: 1970.4 ± 0.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0861
• Weighted residual factors for all reflections included in the refinement: 0.091
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No