Information card for entry 7135723

Structure parameters

• Formula: C26 H30 F6 Fe N6 O7 S2
• Calculated formula: C26 H30 F6 Fe N6 O7 S2
• Title of publication: Ligand field and polarity tuning of Fe(II) complexes for selective ROS-mediated anticancer activity.
• Authors of publication: Lee, Hyewon; Wijayanti, Lucia Wiwid; Park, Hyungbin; Hong, Seungwoo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 33
• Pages of publication: 8491 - 8495
• a: 18.4851 ± 0.0007 Å
• b: 11.4662 ± 0.0004 Å
• c: 16.1722 ± 0.0006 Å
• α: 90°
• β: 110.578 ± 0.0009°
• γ: 90°
• Cell volume: 3209.1 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• 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: 0.0839
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1261
• Weighted residual factors for all reflections included in the refinement: 0.1406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.155
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No