Information card for entry 7062528

Structure parameters

• Formula: C14 H20 N6 O2
• Calculated formula: C14 H20 N6 O2
• Title of publication: An oxalamide-bridged imidazole based ‘turn off’ fluorescent receptor for copper(ii) and iron(iii) ions
• Authors of publication: Murugaperumal, Parvathavarthini; Rajendran, Praveena; Nallathambi, Sengottuvelan; Ayyanar, Siva; Perdih, Franc; Balasubramaniem, Ashokkumar; Alagarsamy, Arun
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 28
• Pages of publication: 13342 - 13352
• a: 8.0049 ± 0.0007 Å
• b: 10.5291 ± 0.0008 Å
• c: 9.2006 ± 0.0008 Å
• α: 90°
• β: 106.405 ± 0.01°
• γ: 90°
• Cell volume: 743.9 ± 0.11 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 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: 0.0553
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No