Information card for entry 4516386

Structure parameters

• Formula: C112 H132 Eu6 N12 O28
• Calculated formula: C112 H132 Eu6 N12 O28
• SMILES: [Eu]1234567[N]89CC[N]%103CC[N]32Cc2cc(cc(c2[O]6[Eu]26%11%12%13([O]=C(c%14cnccc%14)O[Eu]%14%15%16%17%18%19[O]%20[Eu]%21%22%23%24%25%26[N]%27(CC[N]%21(CC[N]%21%22CC[N]%23(CC%27)Cc%22cc(C)cc%23c%22[O]%25[Eu]%22([O]%24c%24c(cc(C)cc%24C%21)OC)([O]=C(c%21cccnc%21)O[Eu]%21([O]4c4c(cc(C)cc4OC)C8)([O]5c4c(cc(C)cc4[O]%21C)C[N]1(CC3)CC9)([O]=C(c1cccnc1)O%14)([OH]%12%18)([O]%19%22)[OH]%13)([O]=C(c1cccnc1)O2)([O]%23C)[O]%11%17)Cc1c(c(cc(c1)C)[O]%16C)[O]%15%26)Cc1c%20c(cc(C)c1)OC)[O]7c1c(C%10)cc(cc1[O]6C)C)OC)C
• Title of publication: First Eu(II)/Ln(III) Mixed Complex with High Oxidative Stability
• Authors of publication: Wei, Yongqin; Wang, Gaoji; Wu, Kechen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 11
• Pages of publication: 5288
• a: 15.246 ± 0.004 Å
• b: 15.252 ± 0.004 Å
• c: 15.28 ± 0.004 Å
• α: 66.002 ± 0.005°
• β: 89.09 ± 0.007°
• γ: 78.068 ± 0.007°
• Cell volume: 3166.6 ± 1.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0698
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for significantly intense reflections: 0.1672
• Weighted residual factors for all reflections included in the refinement: 0.1699
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No