Information card for entry 7717006

Structure parameters

• Formula: C44 H80 Cl3 Fe N4 P2 Si2
• Calculated formula: C44 H80 Cl3 Fe N4 P2 Si2
• Title of publication: Dinitrogen silylation catalyzed by silylene cobalt(I) and silylene iron(I) chlorides.
• Authors of publication: Fan, Qingqing; Li, Qingshuang; Sun, Hongjian; Li, Xiaoyan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 39
• Pages of publication: 16261 - 16270
• a: 21.6307 ± 0.0004 Å
• b: 10.3205 ± 0.0002 Å
• c: 24.7701 ± 0.0005 Å
• α: 90°
• β: 111.412 ± 0.002°
• γ: 90°
• Cell volume: 5148.01 ± 0.19 ų
• Cell temperature: 173.01 ± 0.18 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0629
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No