Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
9590577 | Journal of Molecular Structure: THEOCHEM | 2005 | 6 Pages |
Abstract
The normal mode frequencies and corresponding vibrational assignments of digermyl sulfide in C2v symmetry are examined theoretically using the Gaussian 98 set of quantum chemistry codes. All normal modes were successfully assigned to one of six types of motion (Ge-H stretch, Ge-S stretch, Ge-S-Ge bend, H-Ge-H bend, GeH3 wag, and GeH3 twist) predicted by a group theoretical analysis. Comparing the vibrational frequencies with IR and Raman spectra available in the literature, scaling factors are derived. Predicted infrared and Raman intensities are reported.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
James O. Jensen,