Information card for entry 7210312

Structure parameters

• Formula: C48 H42 Er2 N6 O6
• Calculated formula: C48 H42 Er2 N6 O6
• SMILES: c12ccccc1C=[N]1CC[N]3=Cc4ccccc4O[Er]4513([O]1[Er]36789(N4(=Cc4c(cccc4)[O]57)CC[N]6=Cc4ccccc4O8)[N](CC[N]3=Cc3c1cccc3)=Cc1ccccc1O9)O2
• Title of publication: Syntheses, structure and near-infrared (NIR) luminescence of Er2, Yb2, ErYb of homodinuclear and heterodinuclear lanthanide(iii) complexes based on salen ligand
• Authors of publication: Gao, Ting; Yang, Yu; Sun, Wen-Bin; Li, Guang-Ming; Hou, Guang-Feng; Yan, Peng-Fei; Li, Ji-Tong; Ding, Dan-Dan
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 31
• Pages of publication: 6213
• a: 26.88 ± 0.005 Å
• b: 19.664 ± 0.004 Å
• c: 16.83 ± 0.003 Å
• α: 90°
• β: 101.88 ± 0.03°
• γ: 90°
• Cell volume: 8705 ± 3 ų
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.054
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No