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Solid-state luminescence properties, Hirshfeld surface analysis and DFT calculations of mononuclear lanthanide complexes (Ln = Eu^III, Gd^III, Tb^III, Dy^III) containing 4'-phenyl-2,2':6',2″-terpyridine.

ABSTRACT: Four mononuclear lanthanide complexes containing 4'-phenyl-2,2':6',2″-terpyridine (ptpy), [Ln(NO₃)₃(ptpy) (H₂O)] (Ln = Eu (1), Gd (2), Tb (3), Dy (4)), were solvothermally synthesized and characterized via elemental analysis, infrared spectroscopy, thermogravimetric analysis, single-crystal X-ray diffraction, and powder X-ray diffraction. Hirshfeld surfaces and the solid-state luminescence properties of the complexes were investigated. The 3-D Hirshfeld surface and 2-D fingerprint plots show that the main interactions are the O H/H O intermolecular interactions in 1-4. Solid-state luminescence investigation reveals that Gd^III complex 2 displays a ligand-centered emission and the Eu^III, T

SUBMITTER: Cai LL

PROVIDER: S-EPMC8168451 | biostudies-literature | 2019 Apr

REPOSITORIES: biostudies-literature

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Solid-state luminescence properties, Hirshfeld surface analysis and DFT calculations of mononuclear lanthanide complexes (Ln = Eu^III, Gd^III, Tb^III, Dy^III) containing 4'-phenyl-2,2':6',2″-terpyridine.

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Dataset Information

Solid-state luminescence properties, Hirshfeld surface analysis and DFT calculations of mononuclear lanthanide complexes (Ln = EuIII, GdIII, TbIII, DyIII) containing 4'-phenyl-2,2':6',2″-terpyridine.

OmicsDI is part of the ELIXIR infrastructure

Tweets

Solid-state luminescence properties, Hirshfeld surface analysis and DFT calculations of mononuclear lanthanide complexes (Ln = Eu^III, Gd^III, Tb^III, Dy^III) containing 4'-phenyl-2,2':6',2″-terpyridine.