Information card for entry 7063821

Structure parameters

• Formula: C39.75 H45.51 Fe N4 Na O11
• Calculated formula: C39.753 H45.506 Fe N4 Na O11
• Title of publication: Visual detection of Hg2+ without interference by alkali and alkaline earth metal ions using an iron(iii) complex in a hetero-bimetallic environment
• Authors of publication: Paik, Somnath; Ray, Manabendra
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 23
• Pages of publication: 9980 - 9989
• a: 9.434 ± 0.003 Å
• b: 10.248 ± 0.003 Å
• c: 11.733 ± 0.004 Å
• α: 71.1 ± 0.009°
• β: 76.526 ± 0.008°
• γ: 86.091 ± 0.009°
• Cell volume: 1043.6 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0807
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.0981
• Weighted residual factors for all reflections included in the refinement: 0.1116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No