Information card for entry 2108190

Structure parameters

• Common name: 'Potassium tetrachlorobis(dimethyl sulfoxide)iridate(III) 0.25-hydrate'
• Chemical name: 'Potassium tetrachlorobis(dimethyl sulfoxide)iridate(III) 0.25-hydrate'
• Formula: C4 H12.5 Cl4 Ir K O2.25 S2
• Calculated formula: C4 H12.5 Cl4 Ir K O2.25 S2
• Title of publication: Conformational and structural diversity of iridium dimethyl sulfoxide complexes
• Authors of publication: Ridgway, Benjamin M.; Foi, Ana; Corrêa, Rodrigo S.; Bikiel, Damian E.; Ellena, Javier; Doctorovich, Fabio; Di Salvo, Florencia
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 6
• Pages of publication: 1032 - 1042
• a: 12.753 ± 0.0004 Å
• b: 7.8356 ± 0.0002 Å
• c: 15.3277 ± 0.0005 Å
• α: 90°
• β: 111.581 ± 0.002°
• γ: 90°
• Cell volume: 1424.29 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0602
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1099
• Weighted residual factors for all reflections included in the refinement: 0.1185
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes