Information card for entry 1512852

Structure parameters

• Formula: C44 H40 B Co F4 N4 O4 P2
• Calculated formula: C44 H40 B Co F4 N4 O4 P2
• SMILES: F[B](F)(F)[F-].CCOC1=N[N]2=Cc3c([P]([Co]452(O1)OC(=N[N]4=Cc1c([P]5(c2ccccc2)c2ccccc2)cccc1)OCC)(c1ccccc1)c1ccccc1)cccc3
• Title of publication: Synthesis, characterisation and biological activity of Co(III) complex with the condensation product of 2-(diphenylphosphino)benzaldehyde and ethyl carbazate
• Authors of publication: Milica Milenkovic; Alessia Bacchi; Giulia Cantoni; Sinisa Radulovic; Nevenka Gligorijevic; Sandra Arandelovic; Dusan Sladic; Miroslava Vujcic; Dragana Mitic; Katarina Andelkovic
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 395
• Pages of publication: 33 - 43
• a: 15.677 ± 0.001 Å
• b: 13.403 ± 0.001 Å
• c: 19.949 ± 0.002 Å
• α: 90°
• β: 93.012 ± 0.001°
• γ: 90°
• Cell volume: 4185.9 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.0535
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No