Information card for entry 7127424

Structure parameters

• Formula: C41.5 H37 Cl15 K N O6
• Calculated formula: C41.5 H37 Cl15 K N O6
• Title of publication: Electrocatalytic oxidative Z/E isomerization of a stilbene favoured by the presence of an electroactive persistent radical.
• Authors of publication: Mayorga-Burrezo, Paula; Sporer, Christian; de Sousa, J. Alejandro; Capra, Nicola; Wurst, Klaus; Crivillers, Núria; Veciana, Jaume; Rovira, Concepció
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 91
• Pages of publication: 14211 - 14214
• a: 11.603 ± 0.001 Å
• b: 13.398 ± 0.002 Å
• c: 19.749 ± 0.003 Å
• α: 90.788 ± 0.006°
• β: 105.517 ± 0.007°
• γ: 113.557 ± 0.007°
• Cell volume: 2686.3 ± 0.6 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.142
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.1506
• Weighted residual factors for all reflections included in the refinement: 0.1685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No