Information card for entry 4109622

Structure parameters

• Common name: [(i-Pr2Ph)2nacnacCr]2(N2)
• Formula: C68 H106 Cr2 N6
• Calculated formula: C68 H106 Cr2 N6
• Title of publication: Binding and Activation of Small Molecules by Three-Coordinate Cr(I)
• Authors of publication: Wesley H. Monillas; Glenn P. A. Yap; Leonard A. MacAdams; Klaus H. Theopold
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 8090 - 8091
• a: 16.526 ± 0.003 Å
• b: 19.362 ± 0.004 Å
• c: 13.161 ± 0.003 Å
• α: 90°
• β: 126.411 ± 0.003°
• γ: 90°
• Cell volume: 3389.1 ± 1.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0649
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1287
• Weighted residual factors for all reflections included in the refinement: 0.1419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No