Information card for entry 7048074

Structure parameters

• Formula: C15 H15 Cl N4 O5
• Calculated formula: C15 H15 Cl N4 O5
• Title of publication: A versatile quinoxaline derivative serves as a colorimetric sensor for strongly acidic pH.
• Authors of publication: Bag, Riya; Sikdar, Yeasin; Sahu, Sutapa; Maiti, Dilip K.; Frontera, Antonio; Bauzá, Antonio; Drew, Michael G. B.; Goswami, Sanchita
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 47
• Pages of publication: 17077 - 17085
• a: 8.9676 ± 0.0012 Å
• b: 8.2574 ± 0.0011 Å
• c: 22.319 ± 0.003 Å
• α: 90°
• β: 94.52 ± 0.004°
• γ: 90°
• Cell volume: 1647.6 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0695
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.1677
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No