Information card for entry 7705750

Structure parameters

• Formula: C26 H40 F3 Ir N2 O4 Si2
• Calculated formula: C26 H40 F3 Ir N2 O4 Si2
• Title of publication: 2-Pyridone-stabilized iridium silylene/silyl complexes: structure and QTAIM analysis.
• Authors of publication: Guzmán, Jefferson; Bernal, Ana M.; García-Orduña, Pilar; Lahoz, Fernando J.; Polo, Víctor; Fernández-Alvarez, Francisco J
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 48
• Pages of publication: 17665 - 17673
• a: 9.2857 ± 0.0005 Å
• b: 11.6094 ± 0.0006 Å
• c: 14.774 ± 0.0008 Å
• α: 91.061 ± 0.001°
• β: 96.468 ± 0.001°
• γ: 104.489 ± 0.001°
• Cell volume: 1530.38 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No