High resolution FTIR spectroscopy of the ν1 band of NSCl

Literature Information

Publication Date 2005-01-11
DOI 10.1039/B416215C
Impact Factor 3.676
Authors

Evan G. Robertson, Christopher D. Thompson, Sebastian Lucie, Don McNaughton


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Abstract

The highly reactive molecule thiazyl chloride (NSCl) prepared by pyrolysis of S3N2Cl2 at 70 °C was measured by high resolution (0.003 cm−1) FTIR spectroscopy in the mid-IR region. Detailed analyses of ν1, the hybrid a/b-type band at 1325.6 cm−1, led to assignment of 6275 and 3836 lines, respectively, for the 14N32S35Cl and 14N32S37Cl isotopomers. Fitting to Watson’s A-reduced Hamiltonian led to the first rovibrational constants for the ν1 mode along with an improved set of ground state constants including centrifugal distortion beyond the quartic level.

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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
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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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