Recommanded Product: 402-49-3, Academic researchers, R&D teams, teachers, students, policy makers and the media all rely on us to share knowledge that is reliable, accurate and cutting-edge. 402-49-3, Name is 1-(Bromomethyl)-4-(trifluoromethyl)benzene, SMILES is FC(C1=CC=C(CBr)C=C1)(F)F, belongs to phthalazine compound. In a article, author is Lamera, Esma, introduce new discover of the category.
Two condensed phthalazine compounds were synthesized and characterized by FT-IR, UV-Vis, NMR spectroscopic studies. Single crystal XRD and molecular orbital calculations. Optimized geometrical structures were computed with RB3LYP method with the 6-31G(p, d) basis set. The geometrical parameters of both compounds obtained from Single Crystal XRD were found to be in accord with the calculated (DFT) values. The electronic contribution was measured using the third harmonic generation technique on thin films at 1064 nm for both compounds. Also, the values of dipole moment , the average polarizability , and the first static hyperpolarizability were computed. The theoretical and experimental results confirm the NLO behavior of both compounds.
Sometimes chemists are able to propose two or more mechanisms that are consistent with the available data. If a proposed mechanism predicts the wrong experimental rate law, however, the mechanism must be incorrect.Welcome to check out more blogs about 402-49-3, in my other articles. Computed Properties of https://www.ambeed.com/products/402-49-3.html.
Reference:
Phthalazine – Wikipedia,
,Phthalazine | C8H6N2 – PubChem