Information card for entry 7123876

Structure parameters

• Formula: C49 H57 Cr N O P
• Calculated formula: C49 H57 Cr N O P
• 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: 11.6433 ± 0.0002 Å
• b: 14.5073 ± 0.0004 Å
• c: 15.3365 ± 0.0004 Å
• α: 66.709 ± 0.002°
• β: 70.729 ± 0.002°
• γ: 85.951 ± 0.002°
• Cell volume: 2240.74 ± 0.1 ų
• Cell temperature: 180 ± 0.1 K
• Ambient diffraction temperature: 180 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1637
• Weighted residual factors for all reflections included in the refinement: 0.1718
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No