Information card for entry 4074492

Structure parameters

• Formula: C51 H93 Ir2 N2 P4
• Calculated formula: C51 H93 Ir2 N2 P4
• Title of publication: Dinitrogen Complexes of Pincer-Ligated Iridium
• Authors of publication: Ghosh, Rajshekhar; Kanzelberger, Mira; Emge, Thomas J.; Hall, Gene S.; Goldman, Alan S.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 23
• Pages of publication: 5668
• a: 14.2815 ± 0.0008 Å
• b: 14.4823 ± 0.0008 Å
• c: 14.7312 ± 0.0008 Å
• α: 70.554 ± 0.001°
• β: 89.09 ± 0.001°
• γ: 69.785 ± 0.001°
• Cell volume: 2679.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0213
• Residual factor for significantly intense reflections: 0.019
• Weighted residual factors for significantly intense reflections: 0.0459
• Weighted residual factors for all reflections included in the refinement: 0.0468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No