Infrared laser spectroscopy and rovibrational analysis of the ν5 fundamental of cis-1-chloro-2-fluoroethylene

Literature Information

Publication Date 2000-03-24
DOI 10.1039/A910320L
Impact Factor 3.676
Authors

P. Stoppa, A. Pietropolli Charmet, S. Giorgianni, S. Ghersetti


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Abstract

The infrared spectrum of cis-1-chloro-2-fluoroethylene (cis-CHClCHF) has been investigated in the ν5 band region between 1220 and 1250 cm−1, at a resolution of about 0.002 cm−1, using a tunable diode laser spectrometer. This fundamental of symmetry species A′ yields a strong a/b-hybrid band with contributions of comparable intensity from both the components. The rovibrational analysis led to the identification of 3800 lines (J⩽69, Ka⩽25) for the ν5 band of 35Cl species, whose origin is at 1231.849 cm−1. Using Watson's A-reduction Hamiltonian in the Ir representation, a set of spectroscopic parameters up to sextic centrifugal distortion terms was obtained for the v5=1 state, which turned out to be free from perturbations.

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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
Articles per Year: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

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