Information card for entry 2212210

Structure parameters

• Chemical name: Chlorido(6-diphenylphosphino-2-pyridonato-κ^2^P,N)(6-diphenylphosphino- 2-hydroxypyridine-κ^2^P,N)hydridoiridium(III) chloroform 1.896-solvate
• Formula: C35.896 H29.896 Cl6.688 Ir N2 O2 P2
• Calculated formula: C35.9 H29.9 Cl6.7 Ir N2 O2 P2
• Title of publication: Chlorido(6-diphenylphosphino-2-pyridonato-κ^2^<i>P</i>,<i>N</i>)(6-diphenylphosphino-2-hydroxypyridine-κ^2^<i>P</i>,<i>N</i>)hydridoiridium(III) chloroform 1.896-solvate
• Authors of publication: Takayuki Miyabayashi; Takeshi Hara; Tsuneaki Yamagata; Kazushi Mashima
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: m576 - m578
• a: 11.2208 ± 0.0014 Å
• b: 14.8301 ± 0.0015 Å
• c: 23.188 ± 0.003 Å
• α: 90°
• β: 94.284 ± 0.006°
• γ: 90°
• Cell volume: 3847.8 ± 0.8 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes