One of the major reasons for studying chemical kinetics is to use measurements of the macroscopic properties of a system, Product Details of 141-30-0, such as the rate of change in the concentration of reactants or products with time.In a article, mentioned the application of 141-30-0, Name is 3,6-Dichloropyridazine, molecular formula is C4H2Cl2N2
The electronic structures of C4H2Cl2N2 isomers have been studied by HeI photoelectron spectroscopy (PES) combined with the outer valence Green’s function (OVGF) calculations at 6-311++G(d,p) basis sets. The vertical first ionization potentials for 2,6-dichloropyrazine, 2,3-dichloropyrazine, 4,6-dichloropyrimidine and 3,6-dichloropyridazine are determined to be 9.93, 9.89, 10.45 and 10.07 eV, respectively, and the PE spectra were assigned based on molecular orbital analysis and by comparison with related compounds. The effects of chlorine substituent and different positions of nitrogen atoms in these C4H2Cl2N2 isomers have been carefully analyzed by comparing the C4H2Cl2N2 isomers with their matrixes (pyrazine, pyridazine, pyrimidine). The inductive effect of chlorine substituent leads to the stabilization of the nitrogen lone pair orbitals. The resonance effect predominates over the inductive effect, and the consequence is the destabilization of the pi orbitals. Owing to the different positions, the effects of nitrogen atoms are different and lead to the different sequence of pi orbitals.
The potential utility of systematic synthetic strategy will be applicable to efficient generations of chemical libraries of compounds to find ‘hit’ molecules.Read on for other articles about 141-30-0Product Details of 141-30-0
Reference：
Pyridazine – Wikipedia,
Pyridazine | C4H4N1972 – PubChem