Information card for entry 7244252

Structure parameters

• Formula: C176 H158 Cl4 Eu4 O51 P8
• Calculated formula: C176 H136 Cl4 Eu4 O44 P8
• SMILES: [Eu]1234([Cl][Eu]5([OH2])([O]=P6(Oc7c(c8c(cc7)cccc8)c7c(O6)ccc6ccccc76)O[Eu]67([Cl][Eu]([OH2])([O]=P8(Oc9c(c%10c(cc9)cccc%10)c9c(O8)ccc8ccccc98)O6)([OH]CC)([O]=P6(Oc8c(c9c(cc8)cccc9)c8c(O6)ccc6ccccc86)O7)([O]=P6(Oc7c(c8ccccc8cc7)c7c(O6)ccc6ccccc76)O1)([O]=P1(Oc6c(c7c(O1)ccc1ccccc71)c1c(cc6)cccc1)O4)[OH]CC)([OH2])([O]=P1(Oc4c(c6c(O1)ccc1ccccc61)c1c(cc4)cccc1)O5)([OH]CC)[OH]CC)([O]=P1(Oc4c(c5c(cc4)cccc5)c4c(O1)ccc1ccccc41)O2)([O]=P1(Oc2c(c4c(cc2)cccc4)c2c(O1)ccc1ccccc21)O3)([OH]CC)[OH]CC)([OH2])([OH]CC)[OH]CC.[Cl-].[Cl-]
• Title of publication: Synthesis and multifunctional sensing of axially chiral tetranuclear europium clusters
• Authors of publication: Cui, Dongxu; Zhao, Hong-Lei; Kou, Jun-Ning; Sun, Chun-Yi; Wang, Xinlong; Su, Zhong-Min
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 13.7446 ± 0.0005 Å
• b: 18.4533 ± 0.0007 Å
• c: 20.1499 ± 0.0007 Å
• α: 108.815 ± 0.002°
• β: 107.5 ± 0.002°
• γ: 97.438 ± 0.002°
• Cell volume: 4466.2 ± 0.3 ų
• Cell temperature: 293.02 K
• Ambient diffraction temperature: 293.02 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1093
• Residual factor for significantly intense reflections: 0.0783
• Weighted residual factors for significantly intense reflections: 0.1859
• Weighted residual factors for all reflections included in the refinement: 0.2063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No