Information card for entry 7002774

Structure parameters

• Formula: C33 H48 N2 O Sr
• Calculated formula: C66 H96 N4 O2 Sr2
• Title of publication: β-Diketiminate C‒H activation with heavier group 2 alkyls
• Authors of publication: Crimmin, Mark R.; Barrett, Anthony G. M.; Hill, Michael S.; MacDougall, Dugald J.; Mahon, Mary F.; Procopiou, Panayiotis A.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 44
• Pages of publication: 9715 - 9717
• a: 13.4819 ± 0.0001 Å
• b: 21.4266 ± 0.0002 Å
• c: 21.6732 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6260.76 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P c a b
• Hall space group symbol: -P 2bc 2ac
• Residual factor for all reflections: 0.0774
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0965
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No