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First High Resolution IR Study of the ν14 (A1) A-Type Band of 2-13C-Propene Near 421.847 cm-1
Stephen J. Daunt, Robert Grzywacz Dept. Physics & Astronomy, The University of Tennessee, Knoxville, TN Walter J. Lafferty Optical Technology Division, NIST, Gaithersburg, MD Jean-Marie Flaud Universités Paris Est Créteil et Paris Diderot, LISA, Créteil, France Brant Billinghurst Canadian Light Source, University of Saskatchewan, Saskatoon, SK, Canada
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CLS Far-IR Beamline Brant 2m White cell Bruker IFS125 HR
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Propene Impurity in 2-13C Sample
CLS Survey of cm-1 Propene Impurity in 2-13C Sample v C-Propene v9 2-13C-Propane Room Temp; Res. = cm-1; P = Torr; L = 72 meters
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Cooled Cell (217.25K)-Water Lines Gone
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V14 (A1) Band of 2-13C-Propene
CLS Data PGO Calc.
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Overlap of the v14 P Branch for 2-13C-Propene
with the v9 R-Branch of 2-13C-Propane
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Classic Type A Band (almost)
P-Side R-Side qPK(J) = qRK(J) =
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Central Q- Branch Structure
qQK J-Clumps K = Strongest line is J = K Then J increases while degrading to the red
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Quality of Fit as Seen on R-Side
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Quality of Fit as Seen on P-Side
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Perturbed Q Branch Structures
15 16 Ka = 17 18
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2-13C-Propene v14 Residuals All Line Fit
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Comparison GS Constants from All Line Fit to MW1
IR - This Work MW 1 Craig, Groner, Conrad, Gurusinghe & Tubergen, J. Mol. Spectrosc. 328, 1 (2016)
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Acknowledgements UTK & Dept. of Physics & Astronomy
Canadian Light Source and its support agencies (NSERC, USask, Province of Saskatchewan) NIST Jon Hougen, Bob McKellar, Colin Western, Dennis Tokaryk, Scott Goudreau,
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