Information card for entry 4332828

Structure parameters

• Formula: C41 H32 Co F10 N6 O2 P7
• Calculated formula: C41 H32 Co F10 N6 O2 P7
• SMILES: [Co]12345([P](c6ccccc6)(c6ccccc6)c6ccccc6)([c]6(C(=O)OC)[cH]1[cH]2[cH]3[cH]46)C(=C(C(=C5P1(F)=NP(F)(F)=NP(F)(F)=N1)c1ccccc1)c1ccccc1)P1(F)=NP(F)(F)=NP(F)(F)=N1
• Title of publication: Synthesis and Characterization of Novel Fluorophosphazene-Derived Cobaltacyclopentadienyl Metallacycles: Reagents for Assembly of Aryl-Bridged Fluorophosphazenes
• Authors of publication: Kumar, Muthiah Senthil; Upreti, Shailesh; Elias, Anil J.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 7835 - 7842
• a: 10.563 ± 0.003 Å
• b: 11.418 ± 0.003 Å
• c: 20.883 ± 0.005 Å
• α: 82.733 ± 0.005°
• β: 76.226 ± 0.004°
• γ: 72.19 ± 0.005°
• Cell volume: 2325.1 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1098
• Residual factor for significantly intense reflections: 0.0848
• Weighted residual factors for significantly intense reflections: 0.1925
• Weighted residual factors for all reflections included in the refinement: 0.2177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.182
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No