2013A&A...558A...6C


Query : 2013A&A...558A...6C

2013A&A...558A...6C - Astronomy and Astrophysics, volume 558A6-6 (2013/10-1)

Rotational spectrum of ethyl cyanoacetylene (C2H5C=C-C=N), a compound of potential astrochemical interest.

CARLES S., MOLLENDAL H. and GUILLEMIN J.-C.

Abstract (from CDS):

New radiotelescopes, such as the very sensitive ALMA, will enable the detection of interstellar molecules in much lower concentrations than previously possible. A successful identification of an interstellar molecule requires that laboratory microwave and millimeter-wave spectra are investigated. Several cyanopolyynes and alkynylcarbonitriles have already been detected in the interstellar medium (ISM). Cyanoacetylene (HC=C-C=N) is abundant in the ISM and its methyl derivative, 2-butynenitrile (CH3C=C-C=N), is also present. The next derivative, ethyl cyanoacetylene, (2-pentynenitrile C2H5C=C-C=N) may also be present in interstellar space. We report the rotational spectrum of the ethyl cyanoacetylene (C2H5C=C-C=N). This is hoped to facilitate identifying gaseous ethyl cyanoacetylene in the ISM. We studied the rotational spectrum of C2H5C=C-C=N between 13 and 116 GHz with the microwave spectrometer of the University of Oslo. The spectroscopic study was augmented by high-level quantum-chemical calculations at B3LYP/cc-pVTZ and CCSD/cc-pVTZ levels of theory. We present for the first time the rotational spectrum of the ethyl cyanoacetylene (C2H5C=C-C=N). We assigned 342 transitions of the vibrational ground state, accurate values were obtained for rotational and centrifugal distortion constants, and the dipole moment was determined as well.

Abstract Copyright: ∼

Journal keyword(s): methods: data analysis - surveys - molecular data - methods: analytical - techniques: spectroscopic

VizieR on-line data: <Available at CDS (J/A+A/558/A6): table6.dat>

Simbad objects: 1

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Number of rows : 1
N Identifier Otype ICRS (J2000)
RA
ICRS (J2000)
DEC
Mag U Mag B Mag V Mag R Mag I Sp type #ref
1850 - 2026
#notes
1 TMC-1 MoC 04 41 45.9 +25 41 27           ~ 1872 0

Query : 2013A&A...558A...6C

Basic data :
TMC-1 -- Molecular Cloud
Other object types:
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PoC (MLB,[MOH94]), MoC (TMC), Cld (HCL)
ICRS coord. (ep=J2000) :
04 41 45.9 +25 41 27 [ ] D 1983ApJ...264..517M
FK4 coord. (ep=B1950 eq=1950) :
04 38 42.0 +25 35 45 [ ]
Gal coord. (ep=J2000) :
174.3852 -13.4312 [ ]
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Hierarchy : number of linked objects
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HCL 2 MLB 3-28 TMC-1 [MOH94] 6

References (1872 between 1850 and 2026) (Total 1872)
Simbad bibliographic survey began in 1850 for stars (at least bright stars) and in 1983 for all other objects (outside the solar system).
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