Information card for entry 2020934

Structure parameters

• Chemical name: {2-[Bis(diisopropylphosphanyl)methyl]-6-methylpyridine-κ^2^<i>P</i>,<i>N</i>}Dichloridocobalt(II)
• Formula: C19 H35 Cl2 Co N P2
• Calculated formula: C19 H35 Cl2 Co N P2
• SMILES: c12cccc(C)[n]2[Co](Cl)(Cl)[P](C1P(C(C)C)C(C)C)(C(C)C)C(C)C
• Title of publication: Synthesis and coordination chemistry of the PPN ligand 2-[bis(diisopropylphosphanyl)methyl]-6-methylpyridine
• Authors of publication: Han, Delong; Andres, Benjamin; Spannenberg, Anke; Beweries, Torsten
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2017
• Journal volume: 73
• Journal issue: 11
• Pages of publication: 917 - 922
• a: 8.2603 ± 0.0002 Å
• b: 10.722 ± 0.0003 Å
• c: 13.6314 ± 0.0003 Å
• α: 86.8728 ± 0.001°
• β: 80.5491 ± 0.001°
• γ: 75.6607 ± 0.001°
• Cell volume: 1153.68 ± 0.05 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: 0.0351
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes