15min:
A COMBINED SYNCHROTRON-BASED HIGH RESOLUTION FTIR AND DIODE LASER JET INFRARED SPECTROSCOPY STUDY OF THE CHIRAL MOLECULE CDBrClF.

S. ALBERT, K. KEPPLER ALBERT, M. QUACK, PHYSICAL CHEMISTRY, ETH ZÜRICH, CH-8093 ZÜRICH, SWITZERLAND; PH. LERCH, SWISS LIGHT SOURCE, PAUL-SCHERRER-INSTITUTE, CH-5232 VILLIGEN, SWITZERLAND ; V. BOUDON, LABORATOIRE CARNOT DE BOURGOGNE, UNIVERSITE DE BOURGOGNE, F-21078 DIJON, FRANCE .

The experimental detection of molecular parity violation\footnoteM. Quack, Fundamental symmetries and symmetry violations in Handbook of High Resolution Spectroscopy , Vol.~1(Eds. M. Quack and F. Merkt), Wiley, Chichester, New York \textbf2011, 659-722, M.~Quack, J.~Stohner and M.~Willeke, Annu.~Rev.~Phys.~Chem. \textbf2008, 59 , 741, A.~Bakasov, T.K.~Ha, and M.~Quack, J.~Chem.~Phys. \textbf1998, 109 , 7263, R.~Berger and M.~Quack, J.~Chem.~Phys , \textbf2000, 112 , 3148. DeltaPVE is of great interest because of its importance in the understanding of fundamental aspects of molecular dynamics and symmetries. One possible method for this is measuring rovibrational or rotational frequency shifts in the infrared or microwave spectra of enantiomers\footnoteM.~Quack and J.~Stohner, Phys.~Rev.~Lett. \textbf2000, 84 , 3807, M.~Quack and J.~Stohner. J.~Chem.~Phys. , \textbf2003, 119, 11228.. For that reason we have measured and analysed the rotationally resolved infrared spectrum of CDBrClF as a prototype spectrum for a chiral molecule using three different techniques. The spectrum has been recorded at room temperature with the Zurich Bruker IFS spectrometer ZP 2001\footnoteS. Albert, K. Keppler Albert and M. Quack, High Resolution Fourier Transform Infrared Spectroscopy in Handbook of High Resolution Spectroscopy , Vol.~2 (Eds. M. Quack and F. Merkt), Wiley, Chichester, New York \textbf2011, 965-1019, S. Albert and M. Quack, ChemPhysChem , \textbf2007, 8 , 1271-1281. and with the Bruker interferometer 2009 connected to the Swiss synchrotron\footnoteS. Albert, K.K. Albert, Ph. Lerch and M. Quack, Faraday Discussions \textbf2011, 150 , 71-99. using a resolution of 0.0007~cm-1. In addition, the IR spectrum of CDBrClF has been measured at low temperature with our diode laser jet setup in the nu5 region. The spectra of the two major isotopomers CD81Br35ClF and CD79Br35ClF have been analysed within the nu5 (CCl-stretch), nu4 (CF-stretch) and nu3 (CDF-bend) regions. A detailed rovibrational analysis of these bands is presented. The role for possible experiments in the experimental detection of molecular parity violation shall be discussed.