Information card for entry 7001962

Structure parameters

• Formula: C34 H33 N2
• Calculated formula: C34 H33 N2
• Title of publication: Stable crystalline annulated diaminocarbenes: coordination with rhodium(i), iridium(i) and catalytic hydroformylation studies
• Authors of publication: Dastgir, Sarim; Coleman, Karl S.; Cowley, Andrew R.; Green, Malcolm L. H.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 35
• Pages of publication: 7203
• a: 25.9142 ± 0.0004 Å
• b: 11.055 ± 0.0002 Å
• c: 19.0937 ± 0.0003 Å
• α: 90°
• β: 105.16 ± 0.0008°
• γ: 90°
• Cell volume: 5279.64 ± 0.15 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0848
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for all reflections: 0.086
• Weighted residual factors for significantly intense reflections: 0.0584
• Weighted residual factors for all reflections included in the refinement: 0.0584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0758
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No