Information card for entry 7705566

Structure parameters

• Formula: C62 H53 Cl2 Co N11 O8
• Calculated formula: C62 H53 Cl2 Co N11 O8
• Title of publication: Yellow-to-brown and yellow-to-green electrochromic devices based on complexes of transition metal ions with a triphenylamine-based ligand.
• Authors of publication: Banasz, Radosław; Kubicki, Maciej; Wałęsa-Chorab, Monika
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 42
• Pages of publication: 15041 - 15053
• a: 18.9408 ± 0.001 Å
• b: 9.9747 ± 0.0004 Å
• c: 33.4503 ± 0.0017 Å
• α: 90°
• β: 98.379 ± 0.005°
• γ: 90°
• Cell volume: 6252.3 ± 0.5 ų
• Cell temperature: 130 ± 1 K
• Ambient diffraction temperature: 130 ± 1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1097
• Residual factor for significantly intense reflections: 0.0885
• Weighted residual factors for significantly intense reflections: 0.231
• Weighted residual factors for all reflections included in the refinement: 0.2452
• Goodness-of-fit parameter for all reflections included in the refinement: 1.155
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No