Ayush Shivhare

Dr. Hari Singh Gour University — India

Chemistry · Physical Sciences

4h-index31citations15works3.02yr avg
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Research Topics

Crystallography and molecular interactions(5), Advanced Chemical Physics Studies(3), Crystallization and Solubility Studies(3), Synthesis and biological activity(2), Chemical Synthesis and Reactions(2)

Publications15 total

Energetics of Tetrel, Pnicogen, and Hydrogen Bonds in Microhydrated Clusters of <scp> CO <sub>2</sub> </scp> and <scp> N <sub>2</sub> O </scp>
Journal of Computational Chemistry·2025
Two‐Step Hybrid Method for the Energetics of Individual Noncovalent Interactions in Molecular Crystals
Journal of Computational Chemistry·2025
Appraisal of the Fragments‐In‐Fragments Method for the Energetics of Individual Hydrogen Bonds in Molecular Crystals
Journal of Computational Chemistry·2025· 6 citedOpen Access
Cyclic cooperativity contributions determine the hydrogen bond strengths in molecular clusters
Physical Chemistry Chemical Physics·2025· 7 cited
Synergistic cyclic cooperativity governs the strength of chalcogen, pnictogen and tetrel bonds in microhydrated clusters
Physical Chemistry Chemical Physics·2025· 1 cited
From loose to tight: unveiling bond stretch isomerism in π-complexes of Li, Na and K
Physical Chemistry Chemical Physics·2024· 2 cited
On the synergetic effects of cyclic cooperativity in water clusters
Physical Chemistry Chemical Physics·2024· 5 cited
CCDC 2171330: Experimental Crystal Structure Determination
The Cambridge Structural Database·2023Open Access
Green Synthesis of Electrophilic Alkenes Using a Magnesium Catalyst under Aqueous Conditions and Mechanistic Insights by Density Functional Theory
The Journal of Organic Chemistry·2023· 2 cited
CCDC 2149840: Experimental Crystal Structure Determination
The Cambridge Structural Database·2023Open Access
Palladium(II)-Catalyzed Decarboxylative Difunctionalization of Alkynoic Acids To Access (<i>E</i>)-β-Sulfonylacrylamides and DFT Study
Organic Letters·2023· 7 cited
ChemInform Abstract: Oxidation Studies of N‐Salicyloylflavanone Hydrazones with Selenium Dioxide.
ChemInform·1988
Synthesis of n-isonicotinoyl flavanone hydrazones as possible antibacterial and antitubercular agents.
Indian Journal of Pharmaceutical Sciences·1987· 1 cited
ChemInform Abstract: LEAD TETRAACETATE OXIDATION OF N‐(DICHLOROSALICYLOYL) FLAVANONE HYDRAZONES
Chemischer Informationsdienst·1985
ChemInform Abstract: COURSE OF CYCLIZATION IN THE FORMATION OF NEW N‐DICHLOROSALICYLOYL FLAVANONE HYDRAZONES AND 3,5‐DIPHENYL‐1‐(3,5‐DICHLORO)SALICYLOYLPYRAZOLINES
Chemischer Informationsdienst·1984

Frequent Co-authors

Milind M. Deshmukh(11), Bharti Dehariya(5), Ashok Kale(3), Shashank Tripathi(2), Monty Kumar(2), Ruchir Kant(2), Shridhar R. Gadre(2), Mini Bharati Ahirwar(2), Pankaj Lal Kalar(2), Kavita Jain(2), Swatantra Agrawal(2), Siddique Khan(2), Rampal Vishwakarma(2), Kalpataru Das(2), D. D. Berge(2), Ajay Srivastava(1), Pilankatta K. Ramya(1), Cherumuttathu H. Suresh(1), Chandan Kumar Lenka(1), AV Kale(1)