Information card for entry 4336333

Structure parameters

• Formula: C22 H44 Cl Co N P2 Si
• Calculated formula: C22 H44 Cl Co N P2 Si
• SMILES: [Co]12(Cl)([P](C(C)C)(CC[NH]2CC[P]1(C(C)C)C(C)C)C(C)C)[SiH2]c1ccccc1
• Title of publication: Chemistry of Reduced Monomeric and Dimeric Cobalt Complexes Supported by a PNP Pincer Ligand
• Authors of publication: Sergio S. Rozenel; Rosa Padilla; John Arnold
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11544 - 11550
• a: 10.729 ± 0.003 Å
• b: 20.878 ± 0.003 Å
• c: 12.305 ± 0.002 Å
• α: 90°
• β: 100.01 ± 0.02°
• γ: 90°
• Cell volume: 2714.4 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1889
• Residual factor for significantly intense reflections: 0.1012
• Weighted residual factors for significantly intense reflections: 0.2381
• Weighted residual factors for all reflections included in the refinement: 0.2818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No