The spontaneous self-assembly of a molecular water pipe in 3D space

IUCrJ. 2022 Apr 27;9(Pt 3):364-369. doi: 10.1107/S2052252522003396. eCollection 2022 May 1.

Abstract

The self-assembly and self-organization of water molecules are relevant in many fields of research. When water spontaneously reacts with 2,2,6,6-tetra-methyl-piperidine (TMP) to form colourless and crystalline discrete needles, only in the exact ratio of 2:1, it is important to understand the phenomenon. Single-crystal X-ray and neutron diffraction data have unveiled that TMP self-assembles around columns of water molecules, and as such, the resulting adduct may be described as a series of molecular water pipes.

Keywords: TMP; X-ray diffraction; biomimetic artificial water channels; crystal generation; neutron diffraction; self-assembly; water pipes.

Grants and funding

We thank the EPSRC for funding the UK National Crystallography Service at the University of Southampton for the X-ray structure determination.