Information card for entry 7035996

Structure parameters

• Formula: C30 H30 N21 O3 Tb
• Calculated formula: C30 H30 N21 O3 Tb
• SMILES: c1ccn2[n]1[Tb]13456([n]7cccn7c7cccc(c8nnnn58)[n]17)([n]1cccn1c1cccc(c5nnnn65)[n]31)[n]1c2cccc1c1nnnn41.OC.OC.OC
• Title of publication: Highly luminescent charge-neutral europium(iii) and terbium(iii) complexes with tridentate nitrogen ligands.
• Authors of publication: Senthil Kumar, Kuppusamy; Schäfer, Bernhard; Lebedkin, Sergei; Karmazin, Lydia; Kappes, Manfred M.; Ruben, Mario
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 35
• Pages of publication: 15611 - 15619
• a: 16.98 ± 0.005 Å
• b: 16.98 ± 0.005 Å
• c: 21.806 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5445 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0274
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.0519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No