Information card for entry 7028742

Structure parameters

• Formula: C86 H74 Eu2 N12 O20
• Calculated formula: C86 H74 Eu2 N12 O20
• SMILES: c1cccc2c3[n]4c(nc(n3)c3ccccn3)c3[n](cccc3)[Eu]35674([n]12)([O]=C(O3)COc1ccccc1)([O](C(=[O]5)COc1ccccc1)[Eu]12345([n]8ccccc8c8[n]1c(nc(c1ccccn1)n8)c1[n]2cccc1)([O]=C(O3)COc1ccccc1)([O]7C(=[O]4)COc1ccccc1)[O]=C(O5)COc1ccccc1)[O]=C(O6)COc1ccccc1.CO.CO
• Title of publication: Crystal structure and photoluminescence of two europium compounds with phenoxyacetic acid and 2,4,6-tri(2-pyridyl)-s-triazine.
• Authors of publication: Wang, Ailing; Wei, Xiaoyan; Zhang, Haixia; Yue, Bin; Qu, Yanrong; Kang, Jie; Wang, Zhongxia; Chu, Haibin; Zhao, Yongliang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 6
• Pages of publication: 2620 - 2628
• a: 12.2448 ± 0.001 Å
• b: 13.2214 ± 0.0011 Å
• c: 13.5248 ± 0.0012 Å
• α: 74.8544 ± 0.0015°
• β: 83.0605 ± 0.0016°
• γ: 87.1996 ± 0.0014°
• Cell volume: 2097.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1458
• Weighted residual factors for all reflections included in the refinement: 0.164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No