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Effect of an axial ligand on the self-assembly of molecular platforms.

Chao LiXiangzhi MengAlexander WeismannJan-Simon von GlasenappSebastian HamerFeifei XiangCarlo A PignedoliRainer HergesRichard Berndt
Published in: Physical chemistry chemical physics : PCCP (2022)
Sub-monolayer amounts of trioxatriangulenium (TOTA) molecules functionalized with biphenyl on Ag(111) were investigated with scanning tunnelling microscopy. The molecule is comprised of a rod-shaped axial ligand and a triangular platform that tends to form hydrogen bonds in arrays. Two superstructures are observed, a hexagonal tiling and a phase of molecular double rows. While the former structure matches previous observations from other functionalized TOTA molecules the latter one was unexpected. Aided by density functional theory results, we analyse the observed intramolecular contrast and present a model of the new phase. We discuss possible interaction mechanisms underlying the molecular pattern.
Keyphrases
  • density functional theory
  • single molecule
  • quantum dots
  • high resolution
  • molecular dynamics
  • high throughput
  • magnetic resonance
  • high density