J/A+A/661/A129      Transitions of cysteamine analysis             (Song+, 2022)

Micro- and millimeter-wave spectra of five conformers of cysteamine and their interstellar search. Song W., Maris A., Rivilla V.M., Fortuna F., Evangelisti L., Lv D., Rodriguez-Almeida L., Jimenez-Serra I., Martin-Pintado J., Melandri S. <Astron. Astrophys. 661, A129 (2022)> =2022A&A...661A.129S 2022A&A...661A.129S (SIMBAD/NED BibCode)
ADC_Keywords: Atomic physics ; Spectroscopy ; Molecular clouds Keywords: ISM: molecules - techniques: spectroscopic - methods: laboratory: molecular - molecular data - surveys - line: identification Abstract: Cysteamine (NH2CH2CH2SH), a molecule of potential astrobiological interest, has not yet been detected in the interstellar medium. Furthermore, the sulfur-substituted isomer of ethanolamine (or 2-aminoethanol) has been recently detected in the molecular cloud G+0.693-0.027. In order to conduct a new interstellar search for cysteamine in the molecular cloud G+0.693-0.027, its pure rotational spectrum needs to be investigated in the laboratory. The pulsed-jet Fourier transform microwave spectrometer and the Stark-modulated free-jet millimeter-wave absorption spectrometer were used to measure the purely rotational spectrum of cysteamine in the range of 6.5-18GHz (46.12-16.66mm) and 59.6-120.0GHz (5.03-2.72mm), respectively. We used a deep spectral line survey toward the molecular cloud G+0.693-0.027 obtained with the IRAM 30m and Yebes 40m radiotelescopes to search for cysteamine. We assigned 815 rotational transition lines of five conformers (gGt, gGg, g'Gg, g'Gg', and g'Gt) to fit the rotational constants, quartic centrifugal distortion constants, and the 14N nuclear quadrupole coupling constants. For four conformers (gGt, gGg, g'Gg, and g'Gg'), the 34S isotopologs were observed, and for two of them (gGg and g'Gg), the 13C and 15N isotopolog spectra were also detected; all are in natural abundance. The five conformers of cysteamine were not detected toward the G+0.693-0.027 molecular cloud. We derived upper limits for their molecular abundances compared to molecular hydrogen of<(0.2-1.3)x10-10. The relative abundances with respect to the oxygen counterpart ethanolamine, previously detected toward this cloud, are NH2CH2CH2OH/NH2CH2CH2SH>0.8-5.3. Description: The rotational spectra of cysteamine were recorded in the 6.5-18 GHz and 59.6-103.6GHz frequency using pulsed-jet Fourier transform microwave spectrometer and free-jet millimeter wave absorption spectrometer, respectively. Five conformers were assigned: gGt, gGg, g'Gg, g'Gg' and g'Gt. File Summary: -------------------------------------------------------------------------------- FileName Lrecl Records Explanations -------------------------------------------------------------------------------- ReadMe 80 . This file tables2.dat 56 163 Assignments, measured line positions and least-squares residuals for the analysed transitions of the gGt conformer of cysteamine tables3.dat 56 304 Assignments, measured line positions and least-squares residuals for the analysed transitions of the gGg conformer of cysteamine tables4.dat 56 191 Assignments, measured line positions and least-squares residuals for the analysed transitions of the g'Gg conformer of cysteamine tables5.dat 56 141 Assignments, measured line positions and least-squares residuals for the analysed transitions of the g'Gg' conformer of cysteamine tables6.dat 56 16 Assignments, measured line positions and least-squares residuals for the analysed transitions of the g'Gt conformer of cysteamine tables7.dat 56 16 Assignments, measured line positions and least-squares residuals for the analysed transitions of 34S mono substituted isotopologue for conformer gGt of cysteamine tables8.dat 56 25 Assignments, measured line positions and least-squares residuals for the analysed transitions of 34S mono substituted isotopologue for conformer gGg of cysteamine tables9.dat 56 12 Assignments, measured line positions and least-squares residuals for the analysed transitions of 13C-1 mono substituted isotopologue for conformer gGg of cysteamine tables10.dat 56 14 Assignments, measured line positions and least-squares residuals for the analysed transitions of 13C-2 mono substituted isotopologue for conformer gGg of cysteamine tables11.dat 56 4 Assignments, measured line positions and least-squares residuals for the analysed transitions of 15N mono substituted isotopologue for conformer gGg of cysteamine tables12.dat 56 20 Assignments, measured line positions and least-squares residuals for the analysed transitions of 34S mono substituted isotopologue for conformer g'Gg of cysteamine tables13.dat 56 12 Assignments, measured line positions and least-squares residuals for the analysed transitions of 13C-1 mono substituted isotopologue for conformer g'Gg of cysteamine tables14.dat 56 10 Assignments, measured line positions and least-squares residuals for the analysed transitions of 13C-2 mono substituted isotopologue for conformer g'Gg of cysteamine tables15.dat 56 4 Assignments, measured line positions and least-squares residuals for the analysed transitions of 15N mono substituted isotopologue for conformer g'Gg of cysteamine tables16.dat 56 12 Assignments, measured line positions and least-squares residuals for the analysed transitions of 34S mono substituted isotopologue for conformer g'Gg' of cysteamine tablec1.dat 75 1280 Predicted frequencies of the gGt conformer of cysteamine tablec2.dat 75 882 Predicted frequencies of the gGg conformer of cysteamine tablec3.dat 75 384 Predicted frequencies of the g'Gg conformer of cysteamine tablec4.dat 75 3217 Predicted frequencies of the g'Gg' conformer of cysteamine tablec5.dat 75 3439 Predicted frequencies of the g'Gt conformer of cysteamine -------------------------------------------------------------------------------- Byte-by-byte Description of file: tables[23456789].dat tables1[02346].dat -------------------------------------------------------------------------------- Bytes Format Units Label Explanations -------------------------------------------------------------------------------- 1- 2 I2 --- J' Upper state rotational quantum number J (1) 4- 5 I2 --- Ka' Upper state rotational quantum number Ka (1) 7- 8 I2 --- Kc' Upper state rotational quantum number Kc (1) 10- 11 I2 --- F' Upper state rotational quantum number F (1) 13- 15 I3 --- J Lower state rotational quantum number J (1) 17- 18 I2 --- Ka Lower state rotational quantum number Ka (1) 20- 21 I2 --- Kc Lower state rotational quantum number Kc (1) 23- 24 I2 --- F Lower state rotational quantum number F (1) 30- 40 F11.4 MHz FreqObs Experimental rest frequency (1) 43- 49 F7.4 MHz O-C Observed value minus calculated value (1) 52- 56 F5.3 MHz Error Experimental accuracy (1) -------------------------------------------------------------------------------- Note (1): Transitions in 20-40GHz range are from Nandi's work. -------------------------------------------------------------------------------- Byte-by-byte Description of file: tables11.dat tables15.dat -------------------------------------------------------------------------------- Bytes Format Units Label Explanations -------------------------------------------------------------------------------- 1- 2 I2 --- J' Upper state rotational quantum number J 4- 5 I2 --- Ka' Upper state rotational quantum number Ka 7- 8 I2 --- Kc' Upper state rotational quantum number Kc 10- 12 I3 --- J Lower state rotational quantum number J 14- 15 I2 --- Ka Lower state rotational quantum number Ka 17- 18 I2 --- Kc Lower state rotational quantum number Kc 30- 40 F11.4 MHz FreqObs Experimental rest frequency 43- 49 F7.4 MHz O-C Observed value minus calculated value 52- 56 F5.3 MHz Error Experimental accuracy -------------------------------------------------------------------------------- Byte-by-byte Description of file: tablec[12345].dat -------------------------------------------------------------------------------- Bytes Format Units Label Explanations -------------------------------------------------------------------------------- 3- 13 F11.4 MHz Freq Predicted frequency from experimental spectroscopic constants 16- 21 F6.4 MHz e_Freq Error of the prediction at 1-sigma level 23- 29 F7.4 [nm2.MHz] logI Base 10 logarithm of the integrated intensity 31 I1 --- DR Degrees of freedom in the rotational partition function (0 for atoms, 2 for linear molecules, and 3 for nonlinear molecules) 35- 41 F7.4 cm-1 ELO Lower state energy 43- 44 I2 --- Gup Upper state degeneracy Gup 49- 51 I3 --- TAG Species tag or molecular identifier 53- 55 I3 --- QNFMT Identifies the format of the quantum numbers given in the field QN 56- 57 I2 --- J' Upper state rotational quantum number J 58- 59 I2 --- Ka' Upper state rotational quantum number Ka 60- 61 I2 --- Kc' Upper state rotational quantum number Kc 62- 63 I2 --- F' Upper state rotational quantum number F 68- 69 I2 --- J Lower state rotational quantum number J 70- 71 I2 --- Ka Lower state rotational quantum number Ka 72- 73 I2 --- Kc Lower state rotational quantum number Kc 74- 75 I2 --- F Lower state rotational quantum number F -------------------------------------------------------------------------------- Acknowledgements: Sonia Melandri, References: Nandi et al., J. Mol. Spectrosc., 92, 419
(End) W. Song [BO], S. Melandri [UniBo], P. Vannier [CDS] 20-Apr-2022
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