Information card for entry 4130787

Structure parameters

• Formula: C71 H90 Cl2 Fe N4 O3 Si2
• Calculated formula: C71 H90.001 Cl2.001 Fe N4 O3 Si2.001
• Title of publication: Push-Pull Stabilization of Parent Monochlorosilylenes.
• Authors of publication: Hickox, Hunter P.; Wang, Yuzhong; Xie, Yaoming; Wei, Pingrong; Schaefer, 3rd, Henry F; Robinson, Gregory H.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 31
• Pages of publication: 9799 - 9802
• a: 19.251 ± 0.003 Å
• b: 16.018 ± 0.002 Å
• c: 21.996 ± 0.003 Å
• α: 90°
• β: 92.636 ± 0.002°
• γ: 90°
• Cell volume: 6775.6 ± 1.6 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.101
• Residual factor for significantly intense reflections: 0.0701
• Weighted residual factors for significantly intense reflections: 0.1892
• Weighted residual factors for all reflections included in the refinement: 0.2162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No