Information card for entry 4332830

Structure parameters

• Formula: C23 H17 Co F10 N6 O2 P6
• Calculated formula: C23 H17 Co F10 N6 O2 P6
• SMILES: [Co]1234567([c]8([cH]1[cH]2[cH]3[cH]48)C(=O)OC)[C]1(P2(F)=NP(F)(F)=NP(F)(F)=N2)=[C]5([C]6(P2(F)=NP(F)(F)=NP(F)(F)=N2)=[C]71c1ccccc1)c1ccccc1
• 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: 7.3106 ± 0.0011 Å
• b: 22.024 ± 0.003 Å
• c: 19.681 ± 0.003 Å
• α: 90°
• β: 94.876 ± 0.003°
• γ: 90°
• Cell volume: 3157.3 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0737
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.1325
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No