Information card for entry 1574742

Structure parameters

• Formula: C49 H47 Fe3 N2 O18
• Calculated formula: C49 H47 Fe3 N2 O18
• Title of publication: A biomimetic Fe(III)-metal-organic framework nanosphere-based dual modal probe for aqueous and intracellular sensing of nicotine and its metabolite cotinine.
• Authors of publication: Dhillon, Arshminder Kaur; Jhilta, Agrim; Ladhi, Ritu; Bagdwal, Harshita; Singh, Ashi; Verma, Rahul K.; Singh, Monika
• Journal of publication: Nanoscale
• Year of publication: 2025
• Journal volume: 17
• Journal issue: 24
• Pages of publication: 14630 - 14636
• a: 17.1268 ± 0.0007 Å
• b: 20.8958 ± 0.0009 Å
• c: 27.5204 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9849 ± 0.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0593
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1094
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No