Information card for entry 2003848

Structure parameters

• Formula: C14 H22 I Ir O S
• Calculated formula: C14 H22 I Ir O S
• Title of publication: (η^4^-1,5-Cyclooctadiene)(iodo)(methyl)(thioacetylacetonato)iridium(III)
• Authors of publication: Terblans, Y. M.; Basson, S. S.; Purcell, W.; Lamprecht, G. J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 9
• Pages of publication: 1748 - 1750
• a: 7.879 ± 0.003 Å
• b: 16.867 ± 0.006 Å
• c: 11.826 ± 0.004 Å
• α: 90°
• β: 100.35 ± 0.03°
• γ: 90°
• Cell volume: 1546 ± 1 ų
• Cell temperature: 298 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.054
• Goodness-of-fit parameter for significantly intense reflections: 1.23
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No