Information card for entry 4112153

Structure parameters

• Common name: Compound 4
• Formula: C36 H61 Ag B11 P
• Calculated formula: C36 H61 Ag B11 P
• SMILES: [Ag][P](c1cc(cc(c1)C)C)(c1cc(cc(c1)C)C)c1cc(cc(c1)C)C.[CH]1234[B]567(C)[B]89%10(C)[B]%11%12%13(C)[B]%1458(C)[B]58%11(C)[B]%11%15%12(C)[B]%129%13(C)[B]3%15(C)([B]28%11(C)[B]16%145C)[B]47%10%12C
• Title of publication: Silver-Phosphine Complexes of the Highly Methylated Carborane Monoanion [closo-1-H-CB11Me11]-
• Authors of publication: Adam J. Clarke; Michael J. Ingleson; Gabriele Kociok-Köhn; Mary F. Mahon; Nathan J. Patmore; Jonathan P. Rourke; Giuseppe D. Ruggiero; Andrew S. Weller
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 1503 - 1517
• a: 22.846 ± 0.0006 Å
• b: 12.797 ± 0.0007 Å
• c: 31.273 ± 0.003 Å
• α: 90 ± 0.002°
• β: 106.366 ± 0.003°
• γ: 90 ± 0.004°
• Cell volume: 8772.5 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2944
• Residual factor for significantly intense reflections: 0.1134
• Weighted residual factors for significantly intense reflections: 0.2786
• Weighted residual factors for all reflections included in the refinement: 0.3653
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No