| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1409319 | Journal of Molecular Structure | 2012 | 8 Pages |
Abstract
⺠[Ag(3BrQ)2NO3] is synthesized and its molecular structure is calculated using both HF and DFT methods. ⺠The calculation predicts distorted tetrahedral geometry around silver ion and intramolecular CHâ¯O interactions. ⺠The vibrational spectra of the 3BrQ and [Ag(3BrQ)2NO3] are computed at the same level of theory. ⺠The different vibration modes are assigned based on the TED analysis.
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Physical Sciences and Engineering
Chemistry
Organic Chemistry
Authors
Saied M. Soliman,