Information card for entry 7224349

Structure parameters

• Formula: C36 H28 Eu F2 N7 O10
• Calculated formula: C36 H28 Eu F2 N7 O10
• SMILES: [Eu]123([n]4cccc5c4c4[n]1cccc4cc5)([n]1cccc4c1c1[n]2cccc1cc4)(OC(=O)c1cncc(F)c1)(OC(=O)c1cncc(F)c1)([OH2])ON(=[O]3)=O.O.O
• Title of publication: Self-assembly synthesis, structural features, reversible temperature-induced dehydration/hydration, and magnetic and luminescence properties of lanthanide(iii) compounds derived from 5-fluoronicotinic acid
• Authors of publication: Cui, Yan-Hui; Liang, Xiao-Xiao; Gu, Jin-Zhong; Wu, Jiang; Kirillov, Alexander M.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 13
• Pages of publication: 2303
• a: 8.6142 ± 0.0002 Å
• b: 27.4686 ± 0.0009 Å
• c: 15.3524 ± 0.0004 Å
• α: 90°
• β: 100.233 ± 0.003°
• γ: 90°
• Cell volume: 3574.9 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0709
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No