ABSTRACT
Supramolecular chemistry is a fascinating field that explores the interactions between molecules to create higher-order structures. In the case of the supramolecular chain of Fuchsine acid, which is a type of dye molecule, several chemical applications are possible. Fuchsine acid helps to make better medicine carriers that deliver drugs where they're needed in the body, making treatments more effective and reducing side effects. It also helps create smart materials like sensors and self-fixing plastics, which are useful in electronics, keeping our environment clean, and making new materials. In sensing and detection, the supramolecular chain of Fuchsine acid utilizes as a sensor or detector for specific analyzes. In drug delivery, the supramolecular chains of Fuchsine acid incorporated into drug delivery systems. In recent years, a common method is linking a graph to a chemical structure and using topological descriptors to study it. This technique is becoming increasingly important over time. Topological descriptors gives very useful information while studying the topology of chemical graph. In this paper, we have computed the 3D structure of supramolecular graph of Fuchsine acid. We have computed an explicit expressions of ABC index, GA index, General Randi c ´ index, first and second Zagreb index, hyper Zagreb index, H-index and F-index of supramolecular structure of Fushine acid.
ABSTRACT
Indium phosphide (InP) is a binary semiconductor composed of indium and phosphorus. It has a zinc blende crystal structure, which is a type of cubic lattice structure. This lattice is composed of indium and phosphorus atoms arranged in a lattice of cube-shaped cells, with each cell containing four indium atoms and four phosphorus atoms. This lattice structure is the same for all materials with a zinc blende crystal structure and is the most common type of lattice structure in semiconductors. Indium phosphide (InP) has several chemical applications. It is commonly used as a dopant in the production of semiconductors, where it helps control the electrical properties of the material. InP is also utilized in the synthesis various indium-containing compounds, which can have applications in catalysts and chemical reactions. Additionally, InP nanoparticles have been investigated for their potential use in biomedical imaging and drug delivery systems. The topological characterization of 3D molecular structures can be performed via graph theory. In graph theory, the connections between atoms are represented as edges and the atoms themselves are represented as nodes. Furthermore, graph theory can be used to calculate the topological descriptors of the molecule such as the degree-based and reverse degree-based irregularity toplogical indices. These descriptors can be used to compare the topology of different molecules. This paper deals with the modeling and topological characterization of indium phosphide ( InP ) via degree-based and reverse irregularity indices. The 3D crystal structure of the InP is topologically modeled via partition of the edges, and derived closed form expressions for its irregularity indices. Our obtained results will be surely be helpful in investigating the QSPR/QSAR analysis as well as understanding the deep irregular behavior of the indium phosphide ( InP ) .
ABSTRACT
A numeric quantity that characterizes the whole structure of a network is called a topological index. In the studies of QSAR and QSPR, the topological indices are utilized to predict the physical features related to the bioactivities and chemical reactivity in certain networks. Materials for 2D nanotubes have extraordinary chemical, mechanical, and physical capabilities. They are extremely thin nanomaterials with excellent chemical functionality and anisotropy. Since, 2D materials have the largest surface area and are the thinnest of all known materials, they are ideal for all applications that call for intense surface interactions on a small scale. In this paper, we derived closed formulae for some important neighborhood based irregular topological indices of the 2D nanotubes. Based on the obtained numerical values, a comparative analysis of these computed indices is also performed.
