J/A+A/543/A135   New analysis of 13C-CH3CH2CN up to 1THz  (Richard+, 2012)

Analysis of the terahertz rotational spectrum of the three mono-13C ethyl cyanide (13C-CH3CH2CN). Richard C., Margules L., Motiyenko R.A., Guillemin J.C. <Astron. Astrophys. 543, A135 (2012)> =2012A&A...543A.135R 2012A&A...543A.135R
ADC_Keywords: Atomic physics Keywords: line: identification - method: laboratory - molecular data - techniques: spectroscopic - submillimeter: ISM - ISM: molecules Abstract: Millimeter- and submillimeter-wave spectra of regions such as the Orion molecular cloud show many rotational-torsional lines that are caused by the emission of complex organic molecules (COM). Previous laboratory investigations have been conducted for three isotopologues of ethyl cyanide up to 360GHz, and subsequently, several hundred lines of the three isotopologues have been detected in Orion IRc2 using the IRAM 30m radiotelescope. In this survey we present the analysis based on a Watson Hamiltonian for an asymmetric one-top rotor of the 13C-substituted ethyl cyanide 13CH3CH2CN, CH313CH2CN and CH3CH213CN in the frequency range 480-650GHz and 780-990GHz.The rotational spectra of the three species were measured with a submillimeter spectrometer (50-990GHz) using solid-state sources. A new set of spectroscopic parameters was determined from a least-squares fit procedure for each isotopologue. These parameters permit a new accurate prediction of rotational lines suitable for an astrophysical detection in the submillimeter wave range. Description: The tables present the experimental frequencies of rotational transitions for the three 13C-isotopologues of ethyl cyanide, up to 1THz. The error on the frequency given in the tables is the standard deviation. File Summary: -------------------------------------------------------------------------------- FileName Lrecl Records Explanations -------------------------------------------------------------------------------- ReadMe 80 . This file tableb1.dat 73 2019 Measured transitions of 13CH3CH2CN tableb2.dat 73 2030 Measured transitions of CH313CH2CN tableb3.dat 73 2180 Measured transitions of CH3CH213CN -------------------------------------------------------------------------------- See also: J/A+A/466/255 : Isotopic ethyl cyanide (Demyk+, 2007) J/A+A/493/565 : Deuterated and 15N ethyl cyanides (Margules+, 2009) J/ApJS/184/133 : New ground-state measurements of ethyl cyanide (Brauer+, 2009) J/ApJ/714/476 : Complete spectrum of ethyl cyanide (Fortman+, 2010) Byte-by-byte Description of file: tableb1.dat tableb2.dat tableb3.dat -------------------------------------------------------------------------------- Bytes Format Units Label Explanations -------------------------------------------------------------------------------- 1- 3 I3 --- J0 [1/100] J value of the lower state 7- 8 I2 --- Ka0 [0/33] Ka value of the lower state 11- 13 I3 --- Kc0 [0/100] Kc value of the lower state 17- 18 I2 --- J1 [0/99] J value of the upper state 22- 23 I2 --- Ka1 [0/33] Ka value of the upper state 27- 28 I2 --- Kc1 [0/99] Kc value of the upper state 33- 43 F11.4 MHz Freq [8000/951000] Measured frequency 48- 54 F7.4 MHz O-CA Observed minus calculated frequency in Watson's A reduction 58- 64 F7.4 MHz O-CS Observed minus calculated frequency in Watson's S reduction 68- 73 F6.4 MHz e_Freq Accuracy of the measure (1) -------------------------------------------------------------------------------- Note (1): When accuracy is equal to 0.000, the line were excluded from the fit. -------------------------------------------------------------------------------- Acknowledgements: Cyril Richard, cyril.richard(at)phlam.univ-lille1.fr
(End) Cyril Richard [PhLAM - Lille], Patricia Vannier [CDS] 26-Jun-2012
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