Information card for entry 7133433

Structure parameters

• Chemical name: DRH-04-35
• Formula: C18 H19 N3 O4
• Calculated formula: C18 H19 N3 O4
• Title of publication: Electrochemical removal of toxic metals from reaction media following catalysis.
• Authors of publication: Husbands, David R.; Booth, Elisha M.; Donaldson, Niall W. B.; Kapur, Nikil; Willans, Rebecca M.; Willans, Charlotte E.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 67
• Pages of publication: 8876 - 8879
• a: 11.6692 ± 0.0004 Å
• b: 12.8126 ± 0.0005 Å
• c: 11.3946 ± 0.0005 Å
• α: 90°
• β: 97.665 ± 0.003°
• γ: 90°
• Cell volume: 1688.42 ± 0.12 ų
• Cell temperature: 110 ± 0.1 K
• Ambient diffraction temperature: 110 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0418
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No