Information card for entry 7041860

Structure parameters

• Formula: C74 H56 B2 Co F8 N8 O2
• Calculated formula: C74 H56 B2 Co F8 N8 O2
• Title of publication: Redox properties and electron transfer in a triarylamine-substituted HS-Co(2+)/LS-Co(3+) redox couple.
• Authors of publication: Schnaubelt, Linda; Petzold, Holm; Speck, J Matthäus; Dmitrieva, Evgenia; Rosenkranz, Marco; Korb, Marcus
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 8
• Pages of publication: 2690 - 2698
• a: 13.3143 ± 0.0004 Å
• b: 13.8274 ± 0.0005 Å
• c: 23.1341 ± 0.0006 Å
• α: 91.825 ± 0.002°
• β: 97.651 ± 0.002°
• γ: 110.463 ± 0.003°
• Cell volume: 3940.6 ± 0.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0643
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1437
• Weighted residual factors for all reflections included in the refinement: 0.1504
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No