18 research outputs found
THE ELECTRONIC BAND SYSTEM OF TOLUENE
Author Institution:The electronic band system of the normal isotope of toluene has been photographed and measured at high resolution. Analysis of the strong vibronic components has led to identification of active state fundamentals. The rotational definition of the strong bands near the origin, , suggests that a band contour computation including internal rotation of the methyl group should be attempted. Preliminary results of such as asymmetric top/internal rotation computation will be presented
IDENTIFICATION OF TORSIONAL TRANSITIONS IN THE SUPERSONIC JET SPECTRUM OF MONO-METHYL TETRAZINE
1. C.A. Haynam and D.H. Levy, J. Phys. Chem. 87, 2091 (1983). 2. M.A. Leugers and C.J. Seliskar, J. Mol. Spectrosc. 91, 150-164 (1982). 3. S.M. Beck, M.G. Liverman, D.L. Monts and R.E. Smalley, J. Chem. Phys. 70, 232-237 (1979).Author Institution: Department of Chemistry, University of CincinnatiIdentification of the strong torsional transitions, with and delta m equal to zero, in the high-resolution laser excitation molecular beam spectrum of the methyl tetrazine 5613 {\AA} origin band recently published by Haynam and Levy (1) has been made. Use of their published tetrazine frame rotational constants with results in predicting the positions of the torsional transitions for J up to 3 to within about precision. However, line positions for larger values of J are not adequately calculated using these constants in the asymmetric top/free internal rotor model (2), the fit worstening with increasing J. Reasons for this discrepancy are discussed. Assumption of an equilibrium distribution over both rotation and torsion states for a specified temperature does not quantitatively reproduce the observed molecular beam spectrum intensities. However, a simple model based on a suggestion of Smalley, et al. (3) does produce the observed spectral intensities in at least the simplest of the Haynam and Levy (1) spectra. Indeed, this simple model, with and reproduces the published 500 PSI backing-pressure spectrum on a line-for-line basis
ELECTRONIC BAND CONTOUR CALCULATION OF TOLUENE
E. B. Wilson, JR., C. C. Lin, and D. R. Lide, JR., J. Chem. Phys. 23, 136--142 (1955).Author Institution:The rotational contour of the origin band of toluene has been computed within the framework of the asymmetric top with free internal rotation (1). With the basis |J, Ka, Kc, M, m and the barrier height equal to zero, the energy matrix becomes diagonal in the torsional quantum number, m, and the secular equation is then factorable into even and odd K sub-blocks. The selection rules for dipole radiation are the same as for the rigid asymmetric top with the additional constraint that O. A general program has been written so that the rotational band contour for any molecule in this class may be computed
Error-Prone Polymerase, DNA Polymerase IV, Is Responsible for Transient Hypermutation during Adaptive Mutation in Escherichia coli
The frequencies of nonselected mutations among adaptive Lac(+) revertants of Escherichia coli strains with and without the error-prone DNA polymerase IV (Pol IV) were compared. This frequency was more than sevenfold lower in the Pol IV-defective strain than in the wild-type strain. Thus, the mutations that occur during hypermutation are due to Pol IV