Information card for entry 7126268

Structure parameters

• Formula: C10 H12.67 N0.67 O1.33
• Calculated formula: C10 H12.6667 N0.666667 O1.33333
• Title of publication: Unprecedented reductive cyclisation of salophen ligands to tetrahydroquinoxalines during metal complex formation.
• Authors of publication: Lamb, Katie J.; Dowsett, Mark R.; North, Michael; Parker, Rachel R.; Whitwood, Adrian C.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 35
• Pages of publication: 4844 - 4847
• a: 17.8343 ± 0.0006 Å
• b: 12.4405 ± 0.0004 Å
• c: 13.0921 ± 0.0005 Å
• α: 90°
• β: 107.301 ± 0.004°
• γ: 90°
• Cell volume: 2773.29 ± 0.18 ų
• Cell temperature: 110.05 ± 0.1 K
• Ambient diffraction temperature: 110.05 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0966
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No