Abstract

Spectroscopic data related to the structures of polyatomic molecules in the gas phase have been reviewed, critically evaluated, and compiled. All reported bond distances and angles have been classified as equilibrium (re), average (rz), substitution (rs), or effective (ro) parameters, and have been given a quality rating which is a measure of the parameter uncertainty. The surveyed literature includes work from all of the areas of gas-phase spectroscopy from which precise quantitative structural information can be derived. Introductory material includes definitions of the various types of parameters and a description of the evaluation procedure.

Keywords

Polyatomic ionChemistryMoleculeGas phaseMolecular spectroscopyWork (physics)Measure (data warehouse)Phase (matter)SpectroscopyComputational chemistryStatistical physicsThermodynamicsPhysical chemistryPhysicsQuantum mechanicsData miningOrganic chemistryComputer science

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Publication Info

Year
1979
Type
article
Volume
8
Issue
3
Pages
619-722
Citations
905
Access
Closed

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Marlin D. Harmony, Victor W. Laurie, Robert L. Kuczkowski et al. (1979). Molecular structures of gas-phase polyatomic molecules determined by spectroscopic methods. Journal of Physical and Chemical Reference Data , 8 (3) , 619-722. https://doi.org/10.1063/1.555605

Identifiers

DOI
10.1063/1.555605