Thursday, 23 February 2023

Synthesis, Crystal Structure, and DFT Calculations, of N1,N1 -diethyl-N4 -[(quinolin-2-yl) methylidene] benzene-1,4- diamine | Chapter 1 | Progress in Chemical Science Research Vol. 6

 The title compound N1, N1 -diethyl-N4 -(quinolin-2-ylmethylene)benzene-1,4-diamine (DQMBD) was combined apiece abridgment of the N1, N1 -diethyl-p-phenylenediamine and 2-quinolinecarboxaldehyde. The dihedral angle middle from two points the planes of the quinoline and phenylenediamine rings in the DQMBD is 178.9(3). In the clear, particles are affiliated by C—Hπ interplays, developing in a chain that offers on the way to the a-axle. The title compound was advanced by bulk working hypothesis (DFT) at the B3LYP/6-311++G (d,p) strength level and distinguished accompanying the exploratory dossier. The LUMO- HOMO strength breach is establish expected 3.3080 eV.

Author(s) Details:

Asif Jamal,
PG Department of Chemistry, Langat Singh College (A Constituent Unit of B.R.A. Bihar University) Muzaffarpur, Bihar-842001, India.

Md. Serajul Haque Faizi,
PG Department of Chemistry, Langat Singh College (A Constituent Unit of B.R.A. Bihar University) Muzaffarpur, Bihar-842001, India.

Navedul Haque,
Department of Chemistry, B.R.A. Bihar University, Muzaffarpur, Bihar-842001, India.

Please see the link here: https://stm.bookpi.org/PCSR-V6/article/view/9598

No comments:

Post a Comment