Information card for entry 7030444

Structure parameters

• Formula: C21 H25 Cl Co F6 N5 Sb
• Calculated formula: C21 H25 Cl Co F6 N5 Sb
• SMILES: C1c2cccc[n]2[Co]234(Cl)[N]1(Cc1cccc[n]21)CC[N]3(C)Cc1cccc[n]41.F[Sb](F)(F)([F-])(F)F
• Title of publication: Reinvestigation of the formation of a mononuclear Fe(III) hydroperoxido complex using high pressure kinetics.
• Authors of publication: Nebe, Thomas; Beitat, Alexander; Würtele, Christian; Dücker-Benfer, Carlos; van Eldik, Rudi; McKenzie, Christine J.; Schindler, Siegfried
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 33
• Pages of publication: 7768 - 7773
• a: 18.26 ± 0.004 Å
• b: 9.163 ± 0.0018 Å
• c: 15.057 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2519.3 ± 0.9 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No