Information card for entry 4344584

Structure parameters

• Formula: C38 H41 B Ir N4 O P2
• Calculated formula: C38 H41 B Ir N4 O P2
• Title of publication: Nucleophilicity and P-C Bond Formation Reactions of a Terminal Phosphanido Iridium Complex.
• Authors of publication: Serrano, Ángel L; Casado, Miguel A.; Ciriano, Miguel A.; de Bruin, Bas; López, José A; Tejel, Cristina
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 828 - 839
• a: 9.2199 ± 0.0006 Å
• b: 16.3663 ± 0.0011 Å
• c: 23.4311 ± 0.0016 Å
• α: 90°
• β: 95.314 ± 0.001°
• γ: 90°
• Cell volume: 3520.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.056
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No