Information card for entry 4348969

Structure parameters

• Formula: C28 H30 Cl3 Eu N8 O6
• Calculated formula: C28 H30 Cl3 Eu N8 O6
• SMILES: [Eu]123456([O]=c7[nH]cccc7C=[N]2CC[N]3=Cc2c(=[O]1)[nH]ccc2)[N](=Cc1c([nH]ccc1)=[O]6)CC[N]5=Cc1c(=[O]4)[nH]ccc1.[Cl-].O.[Cl-].[Cl-].O
• Title of publication: A bis(1H-pyridin-2-one)salen Eu(iii) complex for vapoluminescence sensing
• Authors of publication: Shu, Yu-Bo; Liu, Wei-Sheng
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2015
• Journal volume: 2
• Journal issue: 10
• Pages of publication: 927
• a: 15.4368 ± 0.0013 Å
• b: 18.1268 ± 0.0007 Å
• c: 13.4833 ± 0.0008 Å
• α: 90°
• β: 119.572 ± 0.008°
• γ: 90°
• Cell volume: 3281.4 ± 0.4 ų
• Cell temperature: 80 ± 2 K
• Ambient diffraction temperature: 80 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0672
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.1379
• Weighted residual factors for all reflections included in the refinement: 0.1437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No