The infrared spectrum of protonated buckminsterfullerene C60H+

Authors
Publication date 03-2020
Journal Nature Astronomy
Volume | Issue number 4 | 3
Pages (from-to) 240-245
Number of pages 6
Organisations
  • Faculty of Science (FNWI) - Van 't Hoff Institute for Molecular Sciences (HIMS)
Abstract
Although fullerenes have long been hypothesized to occur in interstellar environments, they have only recently been unambiguously identified through spectroscopy. C60, C70 and C60+ now constitute the largest molecular species individually identified in the interstellar medium. Fullerenes have substantial proton affinities and it has been suggested that C60H+ is likely the most abundant interstellar analogue of C60. We present here a laboratory infrared (IR) spectrum of gaseous C60H+. Symmetry breaking in C60H+ produces an IR spectrum that is much richer than that of C60. The experimental spectrum is used to benchmark theoretical spectra indicating that the B3LYP density functional with the 6-311+G(d,p) basis set accurately reproduces the spectrum. Comparison with IR emission spectra from two planetary nebulae, SMP LMC56 and SMC16, which have been associated with high C60 abundances, indicates that C60H+ is a plausible contributor to their IR emission.
Document type Article
Note With supplementary materials
Language English
Published at https://doi.org/10.1038/s41550-019-0941-6
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