Published November 26, 2009 | Version v1
Journal article

Microwave Spectrum of the Argon-Tropolone van der Waals Complex

Description

The rotational spectrum of the argon-tropolone van der Waals complex in the ground vibrational state has been measured in the frequency range of 6 to 17 GHz using a pulsed-jet, Balle-Flygare-type Fourier transform microwave spectrometer. Eighty-six transitions for the complex (Ar-12C7H616O2) were observed, assigned, and fit using a Watson A-reduction Hamiltonian giving the rotational and centrifugal distortion constants A = 1080.4365(3) MHz, B = 883.4943(3) MHz, C = 749.0571(2) MHz, ΔJ = 2.591(2) kHz, ΔJK = -3.32(1) kHz, ΔK = 5.232(9) kHz, (delta)J = 0.944(1) kHz, and (delta)K = -0.028(8) kHz. The tunneling motion of the hydroxyl proton in the tropolone moiety is quenched in the ground electronic state by complexation with argon. The coordinates of the argon atom in the monomer's principal axis system are a = 0.43 (angstrom), b = 0.23 (angstrom), c = 3.48 (angstrom).

Additional details

Identifiers

Publishing Information

Journal Title
Journal of Physical Chemistry. A, Molecules, Spectroscopy, Kinetics, Environment, and General Theory
Journal Volume
113
Journal Issue
47
Journal Page Range
p. 13076-13080
ISSN
1089-5639

INIS

Country of Publication
United States
Country of Input or Organization
United States
INIS RN
41015770
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS;
Descriptors DEI
ARGON; ATOMS; FREQUENCY RANGE; HAMILTONIANS; PROTONS; VIBRATIONAL STATES
Descriptors DEC
BARYONS; ELEMENTARY PARTICLES; ELEMENTS; ENERGY LEVELS; EXCITED STATES; FERMIONS; FLUIDS; GASES; HADRONS; MATHEMATICAL OPERATORS; NONMETALS; NUCLEONS; QUANTUM OPERATORS; RARE GASES

Optional Information

Contract/Grant/Project number
25617; KP1704020; AC05-76RL01830
Notes
doi 10.1021/jp901086a
Funding organization
US Department of Energy (United States)
Secondary number(s)
PNNL-SA--64502