Tuning energetic properties through co-crystallisation – a high-pressure experimental and computational study of nitrotriazolone: 4,4′-bipyridine-Reference-Cited by-同舟云学术

Tuning energetic properties through co-crystallisation – a high-pressure experimental and computational study of nitrotriazolone: 4,4′-bipyridine

Published:2024 Issue:23 Volume:26 Page:16859-16870
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Christopher Imogen L.¹,Liu Xiaojiao²,Lloyd Hayleigh J.¹,Bull Craig L.³^ORCID,Funnell Nicholas P.³^ORCID,Portius Peter⁴^ORCID,Michalchuk Adam A. L.⁵^ORCID,Kennedy Stuart R.¹,Pulham Colin R.¹^ORCID,Morrison Carole A.¹^ORCID

Affiliation:

1. EaSTChem School of Chemistry, The University of Edinburgh, King's Buildings, West Mains Road, Edinburgh, EH9 3FJ, UK

2. Diamond Light Source, Harwell Science and Innovation Campus, Fermi Avenue, Didcot, OX11 0DE, UK

3. ISIS Neutron and Muon Source, Science and Technology Facilities Council, Rutherford Appleton Laboratory, Harwell Campus, Didcot, OX11 0QX, UK

4. Department of Chemistry, University of Sheffield, S3 7HF, UK

5. School of Chemistry, University of Birmingham, Edgbaston, Birmingham, West Midlands, B15 2TT, UK

Abstract

A highly piezochromic co-crystal of the energetic molecule NTO with bipyridine. Colour change attributed to direct compresion of the crystal lattice. No phase transition observed between 0–8 GPa. Impact sensitivity reduced compared to NTO.

Funder

Air Force Office of Scientific Research

Engineering and Physical Sciences Research Council

University of Edinburgh

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D4CP01595A

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