Information card for entry 4335129

Structure parameters

• Formula: C30 H52 B7 Rh3
• Calculated formula: C30 H52 B7 Rh3
• SMILES: [BH]123[BH]456[BH]789[BH]%10%114[BH]415[BH]1%10[Rh]5%10%12%13%148%11([BH]87[Rh]7%11%15%16241%14([c]1([c]7([c]%11([c]%15([c]%161C)C)C)C)C)[Rh]12473698[c]3([c]7([c]4([c]2([c]13C)C)C)C)C)[c]1([c]%13([c]%12([c]%10([c]51C)C)C)C)C
• Title of publication: Supraicosahedral Polyhedra in Metallaboranes: Synthesis and Structural Characterization of 12-, 15-, and 16-Vertex Rhodaboranes
• Authors of publication: Dipak Kumar Roy; Bijan Mondal; Pritam Shankhari; R. S. Anju; K. Geetharani; Shaikh M. Mobin; Sundargopal Ghosh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 6705 - 6712
• a: 8.4703 ± 0.0016 Å
• b: 11.329 ± 0.002 Å
• c: 18.337 ± 0.004 Å
• α: 97.356 ± 0.012°
• β: 92.284 ± 0.013°
• γ: 107.087 ± 0.012°
• Cell volume: 1662.5 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2948
• Residual factor for significantly intense reflections: 0.0865
• Weighted residual factors for significantly intense reflections: 0.1541
• Weighted residual factors for all reflections included in the refinement: 0.223
• Goodness-of-fit parameter for all reflections included in the refinement: 0.917
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No