Information card for entry 7714725

Structure parameters

• Common name: Samarium-fod-bathophenanthroline
• Chemical name: [Sm(fod)3(bath)]
• Formula: C54 H46 F21 N2 O6 Sm
• Calculated formula: C54 H46 F21 N2 O6 Sm
• Title of publication: Heteroleptic samarium complexes with high quantum yields for temperature sensing applications.
• Authors of publication: Ali, Asgar; Ahmed, Zubair; Iftikhar, Khalid; Uddin, Rahis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1105 - 1120
• a: 13.0615 ± 0.0003 Å
• b: 23.2309 ± 0.0004 Å
• c: 37.7006 ± 0.0006 Å
• α: 90°
• β: 93.68 ± 0.002°
• γ: 90°
• Cell volume: 11415.9 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1169
• Weighted residual factors for all reflections included in the refinement: 0.133
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No