Information card for entry 7708679

Structure parameters

• Formula: C30 H47 Fe N2 P3 Si
• Calculated formula: C30 H47 Fe N2 P3 Si
• Title of publication: Synthesis of Silyl Iron Dinitrogen Complexes for Activation of Dihydrogen and Catalytic Silylation of Dinitrogen
• Authors of publication: Chang, Guoliang; Zhang, Peng; Yang, Wenjing; Dong, Yanhong; Xie, Shangqing; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 16.2215 ± 0.0006 Å
• b: 16.2215 ± 0.0006 Å
• c: 24.4132 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6424 ± 0.4 ų
• Cell temperature: 173 ± 0.5 K
• Ambient diffraction temperature: 173 ± 0.5 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.1705
• Weighted residual factors for all reflections included in the refinement: 0.1829
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No