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Detection of the buckminsterfullerene cation (C60+) in space

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 Added by Olivier Berne
 Publication date 2013
  fields Physics
and research's language is English




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In the early 90s, C60+ was proposed as the carrier of two diffuse interstellar bands (DIBs) at 957.7 and 963.2 nm, but a firm identification still awaits gas-phase spectroscopic data. Neutral C60, on the other hand, was recently detected through its infrared emission bands in the interstellar medium and evolved stars. In this contribution, we present the detection of C60+ through its infrared vibrational bands in the NGC 7023 nebula, based on spectroscopic observations with the Spitzer space telescope, quantum chemistry calculation, and laboratory data from the literature. This detection supports the idea that C60+ could be a DIB carrier, and provides robust evidence that fullerenes exist in the gas-phase in the interstellar medium. Modeling efforts to design specific observations, combined with new gas-phase data, will be essential to confirm this proposal. A definitive attribution of the 957.7 and 963.2 nm DIBs to C60+ would represent a significant step forward in the field.



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132 - O. Berne , N. L. J. Cox , G. Mulas 2017
Emission of fullerenes in their infrared vibrational bands has been detected in space near hot stars. The proposed attribution of the diffuse interstellar bands at 9577 and 9632 AA to electronic transitions of the buckminsterfullerene cation (i.e. C$_{60}^+$ ) was recently supported by new laboratory data, confirming the presence of this species in the diffuse interstellar medium (ISM). In this letter, we present the detection, also in the diffuse ISM, of the 17.4 and 18.9 $mu$m emission bands commonly attributed to vibrational bands of neutral C$_{60}$. According to classical models that compute the charge state of large molecules in space, C$_{60}$ is expected to be mostly neutral in the diffuse ISM. This is in agreement with the abundances of diffuse C$_{60}$ we derive here from observations.
Using the Yebes 40m and IRAM 30m radiotelescopes, we detected two series of harmonically related lines in space that can be fitted to a symmetric rotor. The lines have been seen towards the cold dense cores TMC-1, L483, L1527, and L1544. High level of theory ab initio calculations indicate that the best possible candidate is the acetyl cation, CH3CO+, which is the most stable product resulting from the protonation of ketene. We have produced this species in the laboratory and observed its rotational transitions Ju = 10 up to Ju = 27. Hence, we report the discovery of CH3CO+ in space based on our observations, theoretical calculations, and laboratory experiments. The derived rotational and distortion constants allow us to predict the spectrum of CH3CO+ with high accuracy up to 500 GHz. We derive an abundance ratio N(H2CCO)/N(CH3CO+) = 44. The high abundance of the protonated form of H2CCO is due to the high proton affinity of the neutral species. The other isomer, H2CCOH+, is found to be 178.9 kJ/mol above CH3CO+. The observed intensity ratio between the K=0 and K=1 lines, 2.2, strongly suggests that the A and E symmetry states have suffered interconversion processes due to collisions with H and/or H2, or during their formation through the reaction of H3+ with H2CCO.
Context. Insight into the conditions that drive the physics and chemistry in interstellar clouds is gained from determining the abundance and charge state of their components. Aims. We propose an evaluation of the C60:C60+ ratio in diffuse and translucent interstellar clouds that exploits electronic absorption bands so as not to rely on ambiguous IR emission measurements. Methods. The ratio is determined by analyzing archival spectra and literature data. Information on the cation population is obtained from published characteristics of the main diffuse interstellar bands attributed to C60+ and absorption cross sections already reported for the vibronic bands of the cation. The population of neutral molecules is described in terms of upper limit because the relevant vibronic bands of C60 are not brought out by observations. We revise the oscillator strengths reported for C60 and measure the spectrum of the molecule isolated in Ne ice to complete them. Results. We scale down the oscillator strengths for absorption bands of C60 and find an upper limit of approximately 1.3 for the C60:C60+ ratio. Conclusions. We conclude that the fraction of neutral molecules in the buckminsterfullerene population of diffuse and translucent interstellar clouds may be notable despite the non-detection of the expected vibronic bands. More certainty will require improved laboratory data and observations.
Aims. To follow the species chemistry arising in diverse sources of the Galaxy with Herschel. Methods. SPIRE FTS sparse sampled maps of the Orion bar & compact HII regions G29.96-0.02 and G32.80+0.19 have been analyzed. Results. Beyond the wealth of atomic and molecular lines detected in the high-resolution spectra obtained with the FTS of SPIRE in the Orion Bar, one emission line is found to lie at the position of the fundamental rotational transition of CH+ as measured precisely in the laboratory (Pearson & Drouion 2006). This coincidence suggests that it is the first detection of the fundamental rotational transition of CH+. This claim is strengthened by the observation of the lambda doublet transitions arising from its relative, CH, which are also observed in the same spectrum. The broad spectral coverage of the SPIRE FTS allows for the simultaneous measurement of these closely related chemically species, under the same observing conditions. The importance of these lines are discussed and a comparison with results obtained from models of the Photon Dominated Region (PDR) of Orion are presented. The CH+ line also appears in absorption in the spectra of the two galactic compact HII regions G29.96-0.02 and G32.80+0.19, which is likely due to the presence of CH+ in the the Cold Neutral Medium of the galactic plane. These detections will shed light on the formation processes and on the existence of CH+, which are still outstanding questions in astrophysics.
We report the tentative detection in space of the nitrosylium ion, NO$^+$. The observations were performed towards the cold dense core Barnard 1-b. The identification of the NO$^+$ $J$=2--1 line is supported by new laboratory measurements of NO$^+$ rotational lines up to the $J$=8--7 transition (953207.189,MHz), which leads to an improved set of molecular constants: $B_0 = 59597.1379(62)$,MHz, $D_0 = 169.428(65)$,kHz, and $eQq_0(textrm{N}) = -6.72(15)$,MHz. The profile of the feature assigned to NO$^+$ exhibits two velocity components at 6.5 and 7.5 km s$^{-1}$, with column densities of $1.5 times 10^{12}$ and $6.5times10^{11}$ cm$^{-2}$, respectively. New observations of NO and HNO, also reported here, allow to estimate the following abundance ratios: $X$(NO)/$X$(NO$^+$)$simeq511$, and $X$(HNO)/$X$(NO$^+$)$simeq1$. This latter value provides important constraints on the formation and destruction processes of HNO. The chemistry of NO$^+$ and other related nitrogen-bearing species is investigated by the means of a time-dependent gas phase model which includes an updated chemical network according to recent experimental studies. The predicted abundance for NO$^+$ and NO is found to be consistent with the observations. However, that of HNO relative to NO is too high. No satisfactory chemical paths have been found to explain the observed low abundance of HNO. HSCN and HNCS are also reported here with an abundance ratio of $simeq1$. Finally, we have searched for NNO, NO$_2$, HNNO$^+$, and NNOH$^+$, but only upper limits have been obtained for their column density, except for the latter for which we report a tentative 3-$sigma$ detection.
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