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New insights into the structure and chemistry of Titan's tholins via C-13 and N-15 solid state nuclear magnetic resonance spectroscopy

Derenne, S; Coelho, C; Anquetil, C; Szopa, C; Rahman, AS; McMillan, PF; Cora, F; ... Bonhomme, C; + view all (2012) New insights into the structure and chemistry of Titan's tholins via C-13 and N-15 solid state nuclear magnetic resonance spectroscopy. Icarus , 221 (2) 844 - 853. 10.1016/j.icarus.2012.03.003. Green open access

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Abstract

Tholins are complex C,N-containing organic compounds produced in the laboratory. They are considered to provide materials that are analogous to those responsible for the haze observed in Titan’s atmosphere. These compounds present an astrobiological interest due to their ability to release amino acids upon hydrolysis. Their chemical structure has been investigated using a large number of techniques. However, to date no detailed nuclear magnetic resonance (NMR) study has been performed on these materials despite the high potential of this technique for investigating the environment of given nuclei. Here 13C and 15N solid state NMR spectroscopy was applied to obtain new insights into the chemical structure of tholins produced through plasma discharge in gaseous N2single bondCH4 mixtures designed to simulate the atmosphere of Titan. Due to the low natural abundance of these isotopes, a 13C and 15N-enriched tholin sample was synthesized using isotopically enriched gas precursors. Various pulse sequences including 13C and 15N single pulse, 1Hsingle bond13C and 1Hsingle bond15N cross-polarisation and 1Hsingle bond15Nsingle bond13C double cross-polarisation were used. These techniques allowed complete characterisation of the chemical and structural environments of the carbon and nitrogen atoms. The NMR assignments were supplemented and confirmed by ab initio electronic structure calculations for model structures and molecular fragments.

Type: Article
Title: New insights into the structure and chemistry of Titan's tholins via C-13 and N-15 solid state nuclear magnetic resonance spectroscopy
Open access status: An open access version is available from UCL Discovery
DOI: 10.1016/j.icarus.2012.03.003
Publisher version: http://dx.doi.org/10.1016/j.icarus.2012.03.003
Language: English
Additional information: This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY), which permits unrestricted use, distribution, and reproduction in any medium, provided the original author and source are credited.
Keywords: Cosmochemistry, Exobiology, Titan, Atmospheres, Chemistry
UCL classification: UCL
UCL > Provost and Vice Provost Offices > UCL BEAMS
UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Maths and Physical Sciences
UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Maths and Physical Sciences > Dept of Chemistry
URI: https://discovery.ucl.ac.uk/id/eprint/1377547
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