Information card for entry 4072345

Structure parameters

• Formula: C26 H50 Co2 N2 O2 P4
• Calculated formula: C26 H50 Co2 N2 O2 P4
• SMILES: [Co]123([Co]4([NH]1c1cc(ccc1O4)C)([NH]2c1c(O3)ccc(c1)C)([P](C)(C)C)[P](C)(C)C)([P](C)(C)C)[P](C)(C)C
• Title of publication: N-Assisted Carbon−Hydrogen Bond Activation by Cobalt(I) Complexes
• Authors of publication: Wang, Aichen; Sun, Hongjian; Li, Xiaoyan
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 21
• Pages of publication: 5434
• a: 11.1122 ± 0.0004 Å
• b: 23.9375 ± 0.0008 Å
• c: 13.2156 ± 0.0004 Å
• α: 90°
• β: 104.732 ± 0.002°
• γ: 90°
• Cell volume: 3399.8 ± 0.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0742
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0987
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No