191159

New organotellurium compounds based on camphor, aniline and ptoluidine: preparation, characterization, and theoretical study

Article

Last updated: 01 Jan 2025

Subjects

-

Tags

Inorganic chemistry

Abstract

The present study involved the preparation of organomercury and organotellurium compounds derived from camphor and (2-amino-5-methylphenyl) mercury (II) chloride and their derivatives by a condensation reaction. Characterization of the studied compounds was carried out using infrared spectrum (IR), proton nuclear magnetic resonance spectrum (1H NMR), and elemental analysis (C.H.N). The molecular structure of the organotellurium compounds was investigated using the density functional theory with hybrid functional (B3LYP) and the basis set 3-21G. Geometrical structure, HOMO surfaces, LUMO surfaces, and energy gap have been produced throughout the geometry optimization. The molecular geometry and contours for the organotellurium compounds were investigated throughout the geometrical optimization. The donor and acceptor properties have been studied by comparing the highest occupied molecular orbital energies (HOMO) of organotellurium compounds. The electronegativity, electrophilicity, Ionization potential, electron affinity, Chemical Hardness, and Chemical softness for the organotellurium compounds was calculated for the molecules under the study.

DOI

10.21608/ejchem.2021.79236.3893

Keywords

Organotellurium, camphor, mercury chloride, aniline, HOMO, LUMO, DFT

Authors

First Name

Nuha

Last Name

Al-Saadawy

MiddleName

H.

Affiliation

Chemistry, college of science, university of Thi-Qar, Nassiriya, Iraq

Email

nuh.hussain@sci.utq.edu.iq

City

-

Orcid

-

Volume

65

Article Issue

2

Related Issue

28751

Issue Date

2022-02-01

Receive Date

2021-06-05

Publish Date

2022-02-01

Page Start

19

Page End

27

Print ISSN

0449-2285

Online ISSN

2357-0245

Link

https://ejchem.journals.ekb.eg/article_191159.html

Detail API

https://ejchem.journals.ekb.eg/service?article_code=191159

Order

3

Type

Original Article

Type Code

297

Publication Type

Journal

Publication Title

Egyptian Journal of Chemistry

Publication Link

https://ejchem.journals.ekb.eg/

MainTitle

New organotellurium compounds based on camphor, aniline and ptoluidine: preparation, characterization, and theoretical study

Details

Type

Article

Created At

22 Jan 2023