Information card for entry 7060980

Structure parameters

• Formula: C43 H48 Cl Co N2 O3 P2 Si
• Calculated formula: C43 H48 Cl1.005 Co N2 O3 P2 Si
• Title of publication: Synthesis and properties of [PCP] pincer silylene cobalt(i) complexes
• Authors of publication: Li, Yonghui; Fan, Qingqing; Yang, Haiquan; Xie, Shangqing; Huang, Wei; Li, Xiaoyan; Sun, Hongjian; Fuhr, Olaf; Fenske, Dieter
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 42
• Pages of publication: 19950 - 19956
• a: 16.7134 ± 0.0002 Å
• b: 12.4172 ± 0.0002 Å
• c: 22.7388 ± 0.0003 Å
• α: 90°
• β: 90.776 ± 0.001°
• γ: 90°
• Cell volume: 4718.63 ± 0.11 ų
• Cell temperature: 172.99 ± 0.1 K
• Ambient diffraction temperature: 172.99 ± 0.1 K
• Number of distinct elements: 8
• 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: 0.063
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1554
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No