Information card for entry 7123878

Structure parameters

• Formula: C76 H94 Cr2 N2 P2 Si
• Calculated formula: C76 H94 Cr2 N2 P2 Si
• Title of publication: Synthesis and reactivity of asymmetric Cr(I) dinitrogen complexes supported by cyclopentadienyl-phosphine ligands
• Authors of publication: Li, Jiapeng; Yin, Jianhao; Wang, Gao-Xiang; Yin, Zhu-Bao; Zhang, Wen-Xiong; Xi, Zhenfeng
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 17.7239 ± 0.0004 Å
• b: 21.5839 ± 0.0005 Å
• c: 17.9159 ± 0.0004 Å
• α: 90°
• β: 94.801 ± 0.002°
• γ: 90°
• Cell volume: 6829.7 ± 0.3 ų
• Cell temperature: 179.99 ± 0.1 K
• Ambient diffraction temperature: 179.99 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.047
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No