Information card for entry 4085748

Structure parameters

• Formula: C23 H31 Cl Co N P2
• Calculated formula: C23 H31 Cl Co N P2
• SMILES: [N]1([CoH]([P](C)(C)C)([P](C)(C)C)(Cl)c2c(C=1)cccc2)c1cccc2ccccc12
• Title of publication: Synthesis and Reactivity of a Hydrido CNC Pincer Cobalt(III) Complex and Its Application in Hydrosilylation of Aldehydes and Ketones
• Authors of publication: Zhou, Hongwei; Sun, Hongjian; Zhang, Shumiao; Li, Xiaoyan
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 8
• Pages of publication: 1479
• a: 8.6642 ± 0.0003 Å
• b: 8.7247 ± 0.0003 Å
• c: 16.2395 ± 0.0006 Å
• α: 94.891 ± 0.003°
• β: 92.592 ± 0.003°
• γ: 106.975 ± 0.003°
• Cell volume: 1166.66 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0483
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0857
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 0.954
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No