Information card for entry 7004472

Structure parameters

• Formula: C26 H19 Cl4 Ir N2 O3
• Calculated formula: C26 H19 Cl4 Ir N2 O3
• Title of publication: A unique six-membered chelated iridium complex
• Authors of publication: Ammermann, Sven; Daniliuc, Constantin; Jones, Peter G.; du Mont, Wolf-Walther; Kowalsky, Wolfgang; Johannes, Hans-Hermann
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 31
• Pages of publication: 4095 - 4098
• a: 11.4605 ± 0.0011 Å
• b: 14.1259 ± 0.0014 Å
• c: 16.6417 ± 0.0016 Å
• α: 89.693 ± 0.002°
• β: 83.124 ± 0.002°
• γ: 85.74 ± 0.002°
• Cell volume: 2667.3 ± 0.4 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.1015
• Weighted residual factors for all reflections included in the refinement: 0.1083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No